N'-methyl-N-[4-[3-methylbutyl(phenylsulfonyl)amino]-3-oxidanyl-1-phenyl-butan-2-yl]-2-(quinolin-2-ylcarbonylamino)butanediamide

Systemtic Name: N'-methyl-N-[4-[3-methylbutyl(phenylsulfonyl)amino]-3-oxidanyl-1-phenyl-butan-2-yl]-2-(quinolin-2-ylcarbonylamino)butanediamide Openeye Name: N-[3-[benzenesulfonyl(isopentyl)amino]-1-benzyl-2-hydroxy-propyl]-N'-methyl-2-(quinoline-2-carbonylamino)butanediamide CAS Name: N-[4-[benzenesulfonyl(3-methylbutyl)amino]-3-hydroxy-1-phenylbutan-2-yl]-N'-methyl-2-[[oxo(2-quinolinyl)methyl]amino]butanediamide IUPAC Name: N-[4-[benzenesulfonyl(3-methylbutyl)amino]-3-hydroxy-1-phenylbutan-2-yl]-N'-methyl-2-(quinoline-2-carbonylamino)butanediamide Traditional Name: N-[1-benzyl-3-[besyl(isoamyl)amino]-2-hydroxy-propyl]-N'-methyl-2-(quinaldoylamino)succinamide Formula: C36H43N5O6S MolecularWeight: 673.82152

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN(CC(C(CC1=CC=CC=C1)NC(=O)C(CC(=O)NC)NC(=O)C2=NC3=CC=CC=C3C=C2)O)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CC(C)CCN(CC(C(CC1=CC=CC=C1)NC(=O)C(CC(=O)NC)NC(=O)C2=NC3=CC=CC=C3C=C2)O)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C36H43N5O6S/c1-25(2)20-21-41(48(46,47)28-15-8-5-9-16-28)24-33(42)31(22-26-12-6-4-7-13-26)39-36(45)32(23-34(43)37-3)40-35(44)30-19-18-27-14-10-11-17-29(27)38-30/h4-19,25,31-33,42H,20-24H2,1-3H3,(H,37,43)(H,39,45)(H,40,44)