4-methyl-N-[2-(phenethylcarbamoyl)phenyl]-3-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: 4-methyl-N-[2-(phenethylcarbamoyl)phenyl]-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: 4-methyl-N-[2-(phenethylcarbamoyl)phenyl]-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: 4-methyl-N-[2-[oxo-(phenethylamino)methyl]phenyl]-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: 4-methyl-N-[2-(phenethylcarbamoyl)phenyl]-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: 4-methyl-N-[2-(phenethylcarbamoyl)phenyl]-3-pyrrolidinosulfonyl-benzamide Formula: C27H29N3O4S MolecularWeight: 491.60186

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=CC=CC=C2C(=O)NCCC3=CC=CC=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=CC=CC=C2C(=O)NCCC3=CC=CC=C3)S(=O)(=O)N4CCCC4

InChI

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