2-methyl-2-[[2-methylpropyl-[2-oxidanyl-4-[[4-oxidanylidene-4-(quinolin-2-ylcarbonylamino)butanoyl]amino]-4-phenyl-butyl]sulfamoyl]amino]propanoic acid

Systemtic Name: 2-methyl-2-[[2-methylpropyl-[2-oxidanyl-4-[[4-oxidanylidene-4-(quinolin-2-ylcarbonylamino)butanoyl]amino]-4-phenyl-butyl]sulfamoyl]amino]propanoic acid Openeye Name: 2-[[[2-hydroxy-4-[[4-oxo-4-(quinoline-2-carbonylamino)butanoyl]amino]-4-phenyl-butyl]-isobutyl-sulfamoyl]amino]-2-methyl-propanoic acid CAS Name: 2-[[[4-[[1,4-dioxo-4-[[oxo(2-quinolinyl)methyl]amino]butyl]amino]-2-hydroxy-4-phenylbutyl]-(2-methylpropyl)sulfamoyl]amino]-2-methylpropanoic acid IUPAC Name: 2-[[[2-hydroxy-4-[[4-oxo-4-(quinoline-2-carbonylamino)butanoyl]amino]-4-phenylbutyl]-(2-methylpropyl)sulfamoyl]amino]-2-methylpropanoic acid Traditional Name: 2-[[[2-hydroxy-4-[[4-keto-4-(quinaldoylamino)butanoyl]amino]-4-phenyl-butyl]-isobutyl-sulfamoyl]amino]-2-methyl-propionic acid Formula: C32H41N5O8S MolecularWeight: 655.76164

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC(CC(C1=CC=CC=C1)NC(=O)CCC(=O)NC(=O)C2=NC3=CC=CC=C3C=C2)O)S(=O)(=O)NC(C)(C)C(=O)O

Isomeric SMILES

CC(C)CN(CC(CC(C1=CC=CC=C1)NC(=O)CCC(=O)NC(=O)C2=NC3=CC=CC=C3C=C2)O)S(=O)(=O)NC(C)(C)C(=O)O

InChI

InChI=1S/C32H41N5O8S/c1-21(2)19-37(46(44,45)36-32(3,4)31(42)43)20-24(38)18-27(22-10-6-5-7-11-22)34-28(39)16-17-29(40)35-30(41)26-15-14-23-12-8-9-13-25(23)33-26/h5-15,21,24,27,36,38H,16-20H2,1-4H3,(H,34,39)(H,42,43)(H,35,40,41)