4-[[(3-chlorophenyl)-methylsulfonyl-amino]methyl]-N-(2-pyrrolidin-1-ylcarbonylphenyl)benzamide

Systemtic Name: 4-[[(3-chlorophenyl)-methylsulfonyl-amino]methyl]-N-(2-pyrrolidin-1-ylcarbonylphenyl)benzamide Openeye Name: 4-[(3-chloro-N-methylsulfonyl-anilino)methyl]-N-[2-(pyrrolidine-1-carbonyl)phenyl]benzamide CAS Name: 4-[(3-chloro-N-methylsulfonylanilino)methyl]-N-[2-[oxo(1-pyrrolidinyl)methyl]phenyl]benzamide IUPAC Name: 4-[(3-chloro-N-methylsulfonylanilino)methyl]-N-[2-(pyrrolidine-1-carbonyl)phenyl]benzamide Traditional Name: 4-[(3-chloro-N-mesyl-anilino)methyl]-N-[2-(pyrrolidine-1-carbonyl)phenyl]benzamide Formula: C26H26ClN3O4S MolecularWeight: 512.02034

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CC1=CC=C(C=C1)C(=O)NC2=CC=CC=C2C(=O)N3CCCC3)C4=CC(=CC=C4)Cl

Isomeric SMILES

CS(=O)(=O)N(CC1=CC=C(C=C1)C(=O)NC2=CC=CC=C2C(=O)N3CCCC3)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C26H26ClN3O4S/c1-35(33,34)30(22-8-6-7-21(27)17-22)18-19-11-13-20(14-12-19)25(31)28-24-10-3-2-9-23(24)26(32)29-15-4-5-16-29/h2-3,6-14,17H,4-5,15-16,18H2,1H3,(H,28,31)