2-[[5-[(3-carboxy-4-phenyl-thiophen-2-yl)amino]-3,3-dimethyl-5-oxidanylidene-pentanoyl]amino]-4-phenyl-thiophene-3-carboxylic acid

Systemtic Name: 2-[[5-[(3-carboxy-4-phenyl-thiophen-2-yl)amino]-3,3-dimethyl-5-oxidanylidene-pentanoyl]amino]-4-phenyl-thiophene-3-carboxylic acid Openeye Name: 2-[[5-[(3-carboxy-4-phenyl-2-thienyl)amino]-3,3-dimethyl-5-oxo-pentanoyl]amino]-4-phenyl-thiophene-3-carboxylic acid CAS Name: 2-[[5-[(3-carboxy-4-phenyl-2-thiophenyl)amino]-3,3-dimethyl-1,5-dioxopentyl]amino]-4-phenyl-3-thiophenecarboxylic acid IUPAC Name: 2-[[5-[(3-carboxy-4-phenylthiophen-2-yl)amino]-3,3-dimethyl-5-oxopentanoyl]amino]-4-phenylthiophene-3-carboxylic acid Traditional Name: 2-[[5-[(3-carboxy-4-phenyl-2-thienyl)amino]-5-keto-3,3-dimethyl-pentanoyl]amino]-4-phenyl-3-thenoic acid Formula: C29H26N2O6S2 MolecularWeight: 562.65654

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC(=O)NC1=C(C(=CS1)C2=CC=CC=C2)C(=O)O)CC(=O)NC3=C(C(=CS3)C4=CC=CC=C4)C(=O)O

Isomeric SMILES

CC(C)(CC(=O)NC1=C(C(=CS1)C2=CC=CC=C2)C(=O)O)CC(=O)NC3=C(C(=CS3)C4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C29H26N2O6S2/c1-29(2,13-21(32)30-25-23(27(34)35)19(15-38-25)17-9-5-3-6-10-17)14-22(33)31-26-24(28(36)37)20(16-39-26)18-11-7-4-8-12-18/h3-12,15-16H,13-14H2,1-2H3,(H,30,32)(H,31,33)(H,34,35)(H,36,37)