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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > sulfur molecular entity > organosulfur compound > sulfonamide > 4-[[(4-ethylphenyl)sulfonylamino]methyl]-n-[2-[(phenylmethyl)-propan-2-ylamino]ethyl]benzamide
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > oxoacid derivative > sulfur oxoacid derivative > sulfonic acid derivative > sulfonamide > 4-[[(4-ethylphenyl)sulfonylamino]methyl]-n-[2-[(phenylmethyl)-propan-2-ylamino]ethyl]benzamide
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > amide > primary amide > sulfonamide > 4-[[(4-ethylphenyl)sulfonylamino]methyl]-n-[2-[(phenylmethyl)-propan-2-ylamino]ethyl]benzamide

Preferred term

4-[[(4-ethylphenyl)sulfonylamino]methyl]-n-[2-[(phenylmethyl)-propan-2-ylamino]ethyl]benzamide  

Type

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

Broader concept

charge

  • 0

formula

  • C28H35N3O3S

inchi

  • InChI=1S/C28H35N3O3S/c1-4-23-12-16-27(17-13-23)35(33,34)30-20-24-10-14-26(15-11-24)28(32)29-18-19-31(22(2)3)21-25-8-6-5-7-9-25/h5-17,22,30H,4,18-21H2,1-3H3,(H,29,32)

inchikey

  • HTGXHXMUOZRDNL-UHFFFAOYSA-N

mass

  • 493.663

monoisotopicmass

  • 493.23991

smiles

  • CCC1=CC=C(C=C1)S(=O)(=O)NCC2=CC=C(C=C2)C(=O)NCCN(CC3=CC=CC=C3)C(C)C

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:93153

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