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Chemistry, part 1

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > carboxamide > secondary carboxamide > 2-methyl-n-(6-nitro-1,3-benzothiazol-2-yl)-3-phenyl-2-propenamide
organooxygen compound > carboxamide > secondary carboxamide > 2-methyl-n-(6-nitro-1,3-benzothiazol-2-yl)-3-phenyl-2-propenamide
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > amide > primary amide > carboxamide > secondary carboxamide > 2-methyl-n-(6-nitro-1,3-benzothiazol-2-yl)-3-phenyl-2-propenamide
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > olefinic compound > enamide > cinnamamides > 2-methyl-n-(6-nitro-1,3-benzothiazol-2-yl)-3-phenyl-2-propenamide
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > carboxamide > alpha,beta-unsaturated carboxylic acid amide > enamide > cinnamamides > 2-methyl-n-(6-nitro-1,3-benzothiazol-2-yl)-3-phenyl-2-propenamide
... > organooxygen compound > carboxamide > alpha,beta-unsaturated carboxylic acid amide > enamide > cinnamamides > 2-methyl-n-(6-nitro-1,3-benzothiazol-2-yl)-3-phenyl-2-propenamide
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > amide > primary amide > carboxamide > alpha,beta-unsaturated carboxylic acid amide > enamide > cinnamamides > 2-methyl-n-(6-nitro-1,3-benzothiazol-2-yl)-3-phenyl-2-propenamide

Preferred term

2-methyl-n-(6-nitro-1,3-benzothiazol-2-yl)-3-phenyl-2-propenamide  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • 0

formula

  • C17H13N3O3S

inchi

  • InChI=1S/C17H13N3O3S/c1-11(9-12-5-3-2-4-6-12)16(21)19-17-18-14-8-7-13(20(22)23)10-15(14)24-17/h2-10H,1H3,(H,18,19,21)

inchikey

  • NCAVOTMEMZFWEF-UHFFFAOYSA-N

mass

  • 339.370

monoisotopicmass

  • 339.06776

smiles

  • CC(=CC1=CC=CC=C1)C(=O)NC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-]

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:117053

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