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

Systemtic Name: 2-[phenylsulfonyl-(4-propan-2-ylphenyl)amino]-N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]ethanamide Openeye Name: 2-[N-(benzenesulfonyl)-4-isopropyl-anilino]-N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]acetamide CAS Name: 2-[N-(benzenesulfonyl)-4-propan-2-ylanilino]-N-[[4-(1-pyrrolidinylmethyl)phenyl]methyl]acetamide IUPAC Name: 2-[N-(benzenesulfonyl)-4-propan-2-ylanilino]-N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]acetamide Traditional Name: 2-(N-besyl-4-isopropyl-anilino)-N-[4-(pyrrolidinomethyl)benzyl]acetamide Formula: C29H35N3O3S MolecularWeight: 505.6715

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)N(CC(=O)NCC2=CC=C(C=C2)CN3CCCC3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CC(C)C1=CC=C(C=C1)N(CC(=O)NCC2=CC=C(C=C2)CN3CCCC3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C29H35N3O3S/c1-23(2)26-14-16-27(17-15-26)32(36(34,35)28-8-4-3-5-9-28)22-29(33)30-20-24-10-12-25(13-11-24)21-31-18-6-7-19-31/h3-5,8-17,23H,6-7,18-22H2,1-2H3,(H,30,33)