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

Systemtic Name: 2-[(3,4-dimethoxyphenyl)-(phenylsulfonyl)amino]-N-[(4-pyrrolidin-1-ylphenyl)methyl]ethanamide Openeye Name: 2-[N-(benzenesulfonyl)-3,4-dimethoxy-anilino]-N-[(4-pyrrolidin-1-ylphenyl)methyl]acetamide CAS Name: 2-[N-(benzenesulfonyl)-3,4-dimethoxyanilino]-N-[[4-(1-pyrrolidinyl)phenyl]methyl]acetamide IUPAC Name: 2-[N-(benzenesulfonyl)-3,4-dimethoxyanilino]-N-[(4-pyrrolidin-1-ylphenyl)methyl]acetamide Traditional Name: 2-(N-besyl-3,4-dimethoxy-anilino)-N-(4-pyrrolidinobenzyl)acetamide Formula: C27H31N3O5S MolecularWeight: 509.61714

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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)OC

Isomeric SMILES

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

InChI

InChI=1S/C27H31N3O5S/c1-34-25-15-14-23(18-26(25)35-2)30(36(32,33)24-8-4-3-5-9-24)20-27(31)28-19-21-10-12-22(13-11-21)29-16-6-7-17-29/h3-5,8-15,18H,6-7,16-17,19-20H2,1-2H3,(H,28,31)