5-phenyl-3-[propan-2-yl-[2-(4-propylcyclohexyl)ethanoyl]amino]thiophene-2-carboxylic acid

Systemtic Name: 5-phenyl-3-[propan-2-yl-[2-(4-propylcyclohexyl)ethanoyl]amino]thiophene-2-carboxylic acid Openeye Name: 3-[isopropyl-[2-(4-propylcyclohexyl)acetyl]amino]-5-phenyl-thiophene-2-carboxylic acid CAS Name: 3-[[1-oxo-2-(4-propylcyclohexyl)ethyl]-propan-2-ylamino]-5-phenyl-2-thiophenecarboxylic acid IUPAC Name: 5-phenyl-3-[propan-2-yl-[2-(4-propylcyclohexyl)acetyl]amino]thiophene-2-carboxylic acid Traditional Name: 3-[isopropyl-[2-(4-propylcyclohexyl)acetyl]amino]-5-phenyl-2-thenoic acid Formula: C25H33NO3S MolecularWeight: 427.59942

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1CCC(CC1)CC(=O)N(C2=C(SC(=C2)C3=CC=CC=C3)C(=O)O)C(C)C

Isomeric SMILES

CCCC1CCC(CC1)CC(=O)N(C2=C(SC(=C2)C3=CC=CC=C3)C(=O)O)C(C)C

InChI

InChI=1S/C25H33NO3S/c1-4-8-18-11-13-19(14-12-18)15-23(27)26(17(2)3)21-16-22(30-24(21)25(28)29)20-9-6-5-7-10-20/h5-7,9-10,16-19H,4,8,11-15H2,1-3H3,(H,28,29)