5-(dimethylamino)-2-methyl-N-[4-[(4-methylphenyl)sulfonyl-(2-methylpropyl)amino]-3-oxidanyl-1-phenyl-butan-2-yl]benzamide

Systemtic Name: 5-(dimethylamino)-2-methyl-N-[4-[(4-methylphenyl)sulfonyl-(2-methylpropyl)amino]-3-oxidanyl-1-phenyl-butan-2-yl]benzamide Openeye Name: N-[1-benzyl-2-hydroxy-3-[isobutyl(p-tolylsulfonyl)amino]propyl]-5-(dimethylamino)-2-methyl-benzamide CAS Name: 5-(dimethylamino)-N-[3-hydroxy-4-[(4-methylphenyl)sulfonyl-(2-methylpropyl)amino]-1-phenylbutan-2-yl]-2-methylbenzamide IUPAC Name: 5-(dimethylamino)-N-[3-hydroxy-4-[(4-methylphenyl)sulfonyl-(2-methylpropyl)amino]-1-phenylbutan-2-yl]-2-methylbenzamide Traditional Name: N-[1-benzyl-2-hydroxy-3-[isobutyl(tosyl)amino]propyl]-5-(dimethylamino)-2-methyl-benzamide Formula: C31H41N3O4S MolecularWeight: 551.73994

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC(C)C)CC(C(CC2=CC=CC=C2)NC(=O)C3=C(C=CC(=C3)N(C)C)C)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC(C)C)CC(C(CC2=CC=CC=C2)NC(=O)C3=C(C=CC(=C3)N(C)C)C)O

InChI

InChI=1S/C31H41N3O4S/c1-22(2)20-34(39(37,38)27-16-12-23(3)13-17-27)21-30(35)29(18-25-10-8-7-9-11-25)32-31(36)28-19-26(33(5)6)15-14-24(28)4/h7-17,19,22,29-30,35H,18,20-21H2,1-6H3,(H,32,36)