1-[[3-methylbutyl-[1-[(2-methyl-3-methylsulfonyl-propanoyl)amino]-2-oxidanyl-4-phenyl-butyl]sulfamoyl]amino]cyclopentane-1-carboxylic acid

Systemtic Name: 1-[[3-methylbutyl-[1-[(2-methyl-3-methylsulfonyl-propanoyl)amino]-2-oxidanyl-4-phenyl-butyl]sulfamoyl]amino]cyclopentane-1-carboxylic acid Openeye Name: 1-[[[2-hydroxy-1-[(2-methyl-3-methylsulfonyl-propanoyl)amino]-4-phenyl-butyl]-isopentyl-sulfamoyl]amino]cyclopentanecarboxylic acid CAS Name: 1-[[[2-hydroxy-1-[(2-methyl-3-methylsulfonyl-1-oxopropyl)amino]-4-phenylbutyl]-(3-methylbutyl)sulfamoyl]amino]-1-cyclopentanecarboxylic acid IUPAC Name: 1-[[[2-hydroxy-1-[(2-methyl-3-methylsulfonylpropanoyl)amino]-4-phenylbutyl]-(3-methylbutyl)sulfamoyl]amino]cyclopentane-1-carboxylic acid Traditional Name: 1-[[[2-hydroxy-1-[(3-mesyl-2-methyl-propanoyl)amino]-4-phenyl-butyl]-isoamyl-sulfamoyl]amino]cyclopentanecarboxylic acid Formula: C26H43N3O8S2 MolecularWeight: 589.76492

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN(C(C(CCC1=CC=CC=C1)O)NC(=O)C(C)CS(=O)(=O)C)S(=O)(=O)NC2(CCCC2)C(=O)O

Isomeric SMILES

CC(C)CCN(C(C(CCC1=CC=CC=C1)O)NC(=O)C(C)CS(=O)(=O)C)S(=O)(=O)NC2(CCCC2)C(=O)O

InChI

InChI=1S/C26H43N3O8S2/c1-19(2)14-17-29(39(36,37)28-26(25(32)33)15-8-9-16-26)23(27-24(31)20(3)18-38(4,34)35)22(30)13-12-21-10-6-5-7-11-21/h5-7,10-11,19-20,22-23,28,30H,8-9,12-18H2,1-4H3,(H,27,31)(H,32,33)