4-oxidanylidene-4-[[1-oxidanyl-1-oxidanylidene-3-(4-phenylphenyl)propan-2-yl]amino]-3-[(3-phenyl-2-sulfanyl-propanoyl)amino]butanoic acid

Systemtic Name: 4-oxidanylidene-4-[[1-oxidanyl-1-oxidanylidene-3-(4-phenylphenyl)propan-2-yl]amino]-3-[(3-phenyl-2-sulfanyl-propanoyl)amino]butanoic acid Openeye Name: 4-[[2-hydroxy-2-oxo-1-[(4-phenylphenyl)methyl]ethyl]amino]-4-oxo-3-[(3-phenyl-2-sulfanyl-propanoyl)amino]butanoic acid CAS Name: 4-[[1-hydroxy-1-oxo-3-(4-phenylphenyl)propan-2-yl]amino]-3-[(2-mercapto-1-oxo-3-phenylpropyl)amino]-4-oxobutanoic acid IUPAC Name: 4-[[1-hydroxy-1-oxo-3-(4-phenylphenyl)propan-2-yl]amino]-4-oxo-3-[(3-phenyl-2-sulfanylpropanoyl)amino]butanoic acid Traditional Name: 4-[[2-hydroxy-2-keto-1-(4-phenylbenzyl)ethyl]amino]-4-keto-3-[(2-mercapto-3-phenyl-propanoyl)amino]butyric acid Formula: C28H28N2O6S MolecularWeight: 520.59672

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H28N2O6S/c31-25(32)17-22(29-27(34)24(37)16-18-7-3-1-4-8-18)26(33)30-23(28(35)36)15-19-11-13-21(14-12-19)20-9-5-2-6-10-20/h1-14,22-24,37H,15-17H2,(H,29,34)(H,30,33)(H,31,32)(H,35,36)