N-(3-methylphenyl)-2-[3-(4-pyrrolidin-1-ylsulfonylphenyl)propanoylamino]benzamide

Systemtic Name: N-(3-methylphenyl)-2-[3-(4-pyrrolidin-1-ylsulfonylphenyl)propanoylamino]benzamide Openeye Name: N-(m-tolyl)-2-[3-(4-pyrrolidin-1-ylsulfonylphenyl)propanoylamino]benzamide CAS Name: N-(3-methylphenyl)-2-[[1-oxo-3-[4-(1-pyrrolidinylsulfonyl)phenyl]propyl]amino]benzamide IUPAC Name: N-(3-methylphenyl)-2-[3-(4-pyrrolidin-1-ylsulfonylphenyl)propanoylamino]benzamide Traditional Name: N-(m-tolyl)-2-[3-(4-pyrrolidinosulfonylphenyl)propanoylamino]benzamide Formula: C27H29N3O4S MolecularWeight: 491.60186

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)C2=CC=CC=C2NC(=O)CCC3=CC=C(C=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)C2=CC=CC=C2NC(=O)CCC3=CC=C(C=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C27H29N3O4S/c1-20-7-6-8-22(19-20)28-27(32)24-9-2-3-10-25(24)29-26(31)16-13-21-11-14-23(15-12-21)35(33,34)30-17-4-5-18-30/h2-3,6-12,14-15,19H,4-5,13,16-18H2,1H3,(H,28,32)(H,29,31)