ethyl 4-ethyl-5-methyl-2-[(3-methyl-2-phenyl-quinolin-4-yl)carbonylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-ethyl-5-methyl-2-[(3-methyl-2-phenyl-quinolin-4-yl)carbonylamino]thiophene-3-carboxylate Openeye Name: ethyl 4-ethyl-5-methyl-2-[(3-methyl-2-phenyl-quinoline-4-carbonyl)amino]thiophene-3-carboxylate CAS Name: 4-ethyl-5-methyl-2-[[(3-methyl-2-phenyl-4-quinolinyl)-oxomethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-ethyl-5-methyl-2-[(3-methyl-2-phenylquinoline-4-carbonyl)amino]thiophene-3-carboxylate Traditional Name: 4-ethyl-5-methyl-2-[(3-methyl-2-phenyl-quinoline-4-carbonyl)amino]thiophene-3-carboxylic acid ethyl ester Formula: C27H26N2O3S MolecularWeight: 458.57194

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=C1C(=O)OCC)NC(=O)C2=C(C(=NC3=CC=CC=C32)C4=CC=CC=C4)C)C

Isomeric SMILES

CCC1=C(SC(=C1C(=O)OCC)NC(=O)C2=C(C(=NC3=CC=CC=C32)C4=CC=CC=C4)C)C

InChI

InChI=1S/C27H26N2O3S/c1-5-19-17(4)33-26(23(19)27(31)32-6-2)29-25(30)22-16(3)24(18-12-8-7-9-13-18)28-21-15-11-10-14-20(21)22/h7-15H,5-6H2,1-4H3,(H,29,30)