2-[(3-chloranyl-4-methyl-phenyl)-(phenylsulfonyl)amino]-N-[(4-pyrrolidin-1-ylphenyl)methyl]ethanamide

Systemtic Name: 2-[(3-chloranyl-4-methyl-phenyl)-(phenylsulfonyl)amino]-N-[(4-pyrrolidin-1-ylphenyl)methyl]ethanamide Openeye Name: 2-[N-(benzenesulfonyl)-3-chloro-4-methyl-anilino]-N-[(4-pyrrolidin-1-ylphenyl)methyl]acetamide CAS Name: 2-[N-(benzenesulfonyl)-3-chloro-4-methylanilino]-N-[[4-(1-pyrrolidinyl)phenyl]methyl]acetamide IUPAC Name: 2-[N-(benzenesulfonyl)-3-chloro-4-methylanilino]-N-[(4-pyrrolidin-1-ylphenyl)methyl]acetamide Traditional Name: 2-(N-besyl-3-chloro-4-methyl-anilino)-N-(4-pyrrolidinobenzyl)acetamide Formula: C26H28ClN3O3S MolecularWeight: 498.03682

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N(CC(=O)NCC2=CC=C(C=C2)N3CCCC3)S(=O)(=O)C4=CC=CC=C4)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)N(CC(=O)NCC2=CC=C(C=C2)N3CCCC3)S(=O)(=O)C4=CC=CC=C4)Cl

InChI

InChI=1S/C26H28ClN3O3S/c1-20-9-12-23(17-25(20)27)30(34(32,33)24-7-3-2-4-8-24)19-26(31)28-18-21-10-13-22(14-11-21)29-15-5-6-16-29/h2-4,7-14,17H,5-6,15-16,18-19H2,1H3,(H,28,31)