N-cyclopropyl-2-[3-[(4-methylphenyl)-(4-methylphenyl)sulfonyl-amino]propanoylamino]benzamide

Systemtic Name: N-cyclopropyl-2-[3-[(4-methylphenyl)-(4-methylphenyl)sulfonyl-amino]propanoylamino]benzamide Openeye Name: N-cyclopropyl-2-[3-[4-methyl-N-(p-tolylsulfonyl)anilino]propanoylamino]benzamide CAS Name: N-cyclopropyl-2-[[3-(4-methyl-N-(4-methylphenyl)sulfonylanilino)-1-oxopropyl]amino]benzamide IUPAC Name: N-cyclopropyl-2-[3-(4-methyl-N-(4-methylphenyl)sulfonylanilino)propanoylamino]benzamide Traditional Name: N-cyclopropyl-2-[3-(4-methyl-N-tosyl-anilino)propanoylamino]benzamide Formula: C27H29N3O4S MolecularWeight: 491.60186

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N(CCC(=O)NC2=CC=CC=C2C(=O)NC3CC3)S(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)N(CCC(=O)NC2=CC=CC=C2C(=O)NC3CC3)S(=O)(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C27H29N3O4S/c1-19-7-13-22(14-8-19)30(35(33,34)23-15-9-20(2)10-16-23)18-17-26(31)29-25-6-4-3-5-24(25)27(32)28-21-11-12-21/h3-10,13-16,21H,11-12,17-18H2,1-2H3,(H,28,32)(H,29,31)