5-(5-furo[3,2-b]pyridin-2-ylthiophen-2-yl)-3-[(4-methylcyclohexyl)carbonyl-propan-2-yl-amino]thiophene-2-carboxylic acid

Systemtic Name: 5-(5-furo[3,2-b]pyridin-2-ylthiophen-2-yl)-3-[(4-methylcyclohexyl)carbonyl-propan-2-yl-amino]thiophene-2-carboxylic acid Openeye Name: 5-(5-furo[3,2-b]pyridin-2-yl-2-thienyl)-3-[isopropyl-(4-methylcyclohexanecarbonyl)amino]thiophene-2-carboxylic acid CAS Name: 5-[5-(2-furo[3,2-b]pyridinyl)-2-thiophenyl]-3-[[(4-methylcyclohexyl)-oxomethyl]-propan-2-ylamino]-2-thiophenecarboxylic acid IUPAC Name: 5-(5-furo[3,2-b]pyridin-2-ylthiophen-2-yl)-3-[(4-methylcyclohexanecarbonyl)-propan-2-ylamino]thiophene-2-carboxylic acid Traditional Name: 5-(5-furo[3,2-b]pyridin-2-yl-2-thienyl)-3-[isopropyl-(4-methylcyclohexanecarbonyl)amino]-2-thenoic acid Formula: C27H28N2O4S2 MolecularWeight: 508.65222

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)C(=O)N(C2=C(SC(=C2)C3=CC=C(S3)C4=CC5=C(O4)C=CC=N5)C(=O)O)C(C)C

Isomeric SMILES

CC1CCC(CC1)C(=O)N(C2=C(SC(=C2)C3=CC=C(S3)C4=CC5=C(O4)C=CC=N5)C(=O)O)C(C)C

InChI

InChI=1S/C27H28N2O4S2/c1-15(2)29(26(30)17-8-6-16(3)7-9-17)19-14-24(35-25(19)27(31)32)23-11-10-22(34-23)21-13-18-20(33-21)5-4-12-28-18/h4-5,10-17H,6-9H2,1-3H3,(H,31,32)