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Concept information

... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > c-nitro compound > 1-[[4-(2-methylpropoxy)phenyl]methyl]-3-[(4-nitrophenyl)methylideneamino]thiourea

Preferred term

1-[[4-(2-methylpropoxy)phenyl]methyl]-3-[(4-nitrophenyl)methylideneamino]thiourea  

Type

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

Broader concept

charge

  • 0

formula

  • C19H22N4O3S

inchi

  • InChI=1S/C19H22N4O3S/c1-14(2)13-26-18-9-5-15(6-10-18)11-20-19(27)22-21-12-16-3-7-17(8-4-16)23(24)25/h3-10,12,14H,11,13H2,1-2H3,(H2,20,22,27)

inchikey

  • JNCKNSXNGDOGFE-UHFFFAOYSA-N

mass

  • 386.470

monoisotopicmass

  • 386.14126

smiles

  • CC(C)COC1=CC=C(C=C1)CNC(=S)NN=CC2=CC=C(C=C2)[N+](=O)[O-]

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:112383

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