2-[(2,3-dimethylphenyl)-(phenylsulfonyl)amino]-N-(2-methoxy-5-pyrrolidin-1-ylsulfonyl-phenyl)ethanamide

Systemtic Name: 2-[(2,3-dimethylphenyl)-(phenylsulfonyl)amino]-N-(2-methoxy-5-pyrrolidin-1-ylsulfonyl-phenyl)ethanamide Openeye Name: 2-[N-(benzenesulfonyl)-2,3-dimethyl-anilino]-N-(2-methoxy-5-pyrrolidin-1-ylsulfonyl-phenyl)acetamide CAS Name: 2-[N-(benzenesulfonyl)-2,3-dimethylanilino]-N-[2-methoxy-5-(1-pyrrolidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-[N-(benzenesulfonyl)-2,3-dimethylanilino]-N-(2-methoxy-5-pyrrolidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-(N-besyl-2,3-dimethyl-anilino)-N-(2-methoxy-5-pyrrolidinosulfonyl-phenyl)acetamide Formula: C27H31N3O6S2 MolecularWeight: 557.68154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N(CC(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCC3)OC)S(=O)(=O)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C(=CC=C1)N(CC(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCC3)OC)S(=O)(=O)C4=CC=CC=C4)C

InChI

InChI=1S/C27H31N3O6S2/c1-20-10-9-13-25(21(20)2)30(38(34,35)22-11-5-4-6-12-22)19-27(31)28-24-18-23(14-15-26(24)36-3)37(32,33)29-16-7-8-17-29/h4-6,9-15,18H,7-8,16-17,19H2,1-3H3,(H,28,31)