2-[4-[(3-carboxy-4-phenyl-thiophen-2-yl)carbonylamino]butylcarbamoyl]-4-phenyl-thiophene-3-carboxylic acid

Systemtic Name: 2-[4-[(3-carboxy-4-phenyl-thiophen-2-yl)carbonylamino]butylcarbamoyl]-4-phenyl-thiophene-3-carboxylic acid Openeye Name: 2-[4-[(3-carboxy-4-phenyl-thiophene-2-carbonyl)amino]butylcarbamoyl]-4-phenyl-thiophene-3-carboxylic acid CAS Name: 2-[[4-[[(3-carboxy-4-phenyl-2-thiophenyl)-oxomethyl]amino]butylamino]-oxomethyl]-4-phenyl-3-thiophenecarboxylic acid IUPAC Name: 2-[4-[(3-carboxy-4-phenylthiophene-2-carbonyl)amino]butylcarbamoyl]-4-phenylthiophene-3-carboxylic acid Traditional Name: 2-[4-[(3-carboxy-4-phenyl-thiophene-2-carbonyl)amino]butylcarbamoyl]-4-phenyl-3-thenoic acid Formula: C28H24N2O6S2 MolecularWeight: 548.62996

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CSC(=C2C(=O)O)C(=O)NCCCCNC(=O)C3=C(C(=CS3)C4=CC=CC=C4)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=CSC(=C2C(=O)O)C(=O)NCCCCNC(=O)C3=C(C(=CS3)C4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C28H24N2O6S2/c31-25(23-21(27(33)34)19(15-37-23)17-9-3-1-4-10-17)29-13-7-8-14-30-26(32)24-22(28(35)36)20(16-38-24)18-11-5-2-6-12-18/h1-6,9-12,15-16H,7-8,13-14H2,(H,29,31)(H,30,32)(H,33,34)(H,35,36)