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

Systemtic Name: 2-[(3-chloranyl-4-methoxy-phenyl)-(phenylsulfonyl)amino]-N-[(4-pyrrolidin-1-ylphenyl)methyl]ethanamide Openeye Name: 2-[N-(benzenesulfonyl)-3-chloro-4-methoxy-anilino]-N-[(4-pyrrolidin-1-ylphenyl)methyl]acetamide CAS Name: 2-[N-(benzenesulfonyl)-3-chloro-4-methoxyanilino]-N-[[4-(1-pyrrolidinyl)phenyl]methyl]acetamide IUPAC Name: 2-[N-(benzenesulfonyl)-3-chloro-4-methoxyanilino]-N-[(4-pyrrolidin-1-ylphenyl)methyl]acetamide Traditional Name: 2-(N-besyl-3-chloro-4-methoxy-anilino)-N-(4-pyrrolidinobenzyl)acetamide Formula: C26H28ClN3O4S MolecularWeight: 514.03622

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)N(CC(=O)NCC2=CC=C(C=C2)N3CCCC3)S(=O)(=O)C4=CC=CC=C4)Cl

Isomeric SMILES

COC1=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/C26H28ClN3O4S/c1-34-25-14-13-22(17-24(25)27)30(35(32,33)23-7-3-2-4-8-23)19-26(31)28-18-20-9-11-21(12-10-20)29-15-5-6-16-29/h2-4,7-14,17H,5-6,15-16,18-19H2,1H3,(H,28,31)