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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)CCC(=O)NC3=CC=CC=C3C(=O)NCC4=CC=CC=C4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)CCC(=O)NC3=CC=CC=C3C(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C27H29N3O4S/c31-26(17-14-21-12-15-23(16-13-21)35(33,34)30-18-6-7-19-30)29-25-11-5-4-10-24(25)27(32)28-20-22-8-2-1-3-9-22/h1-5,8-13,15-16H,6-7,14,17-20H2,(H,28,32)(H,29,31)