2-[(3-methylphenyl)carbonylamino]-N-[(4-piperidin-1-ylsulfonylphenyl)methyl]benzamide

Systemtic Name: 2-[(3-methylphenyl)carbonylamino]-N-[(4-piperidin-1-ylsulfonylphenyl)methyl]benzamide Openeye Name: 2-[(3-methylbenzoyl)amino]-N-[[4-(1-piperidylsulfonyl)phenyl]methyl]benzamide CAS Name: 2-[[(3-methylphenyl)-oxomethyl]amino]-N-[[4-(1-piperidinylsulfonyl)phenyl]methyl]benzamide IUPAC Name: 2-[(3-methylbenzoyl)amino]-N-[(4-piperidin-1-ylsulfonylphenyl)methyl]benzamide Traditional Name: 2-(m-toluoylamino)-N-(4-piperidinosulfonylbenzyl)benzamide Formula: C27H29N3O4S MolecularWeight: 491.60186

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC2=CC=CC=C2C(=O)NCC3=CC=C(C=C3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NC2=CC=CC=C2C(=O)NCC3=CC=C(C=C3)S(=O)(=O)N4CCCCC4

InChI

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