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

Systemtic Name: propan-2-yl 4-cyano-3-methyl-5-[(3-methyl-2-phenyl-quinolin-4-yl)carbonylamino]thiophene-2-carboxylate Openeye Name: isopropyl 4-cyano-3-methyl-5-[(3-methyl-2-phenyl-quinoline-4-carbonyl)amino]thiophene-2-carboxylate CAS Name: 4-cyano-3-methyl-5-[[(3-methyl-2-phenyl-4-quinolinyl)-oxomethyl]amino]-2-thiophenecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-cyano-3-methyl-5-[(3-methyl-2-phenylquinoline-4-carbonyl)amino]thiophene-2-carboxylate Traditional Name: 4-cyano-3-methyl-5-[(3-methyl-2-phenyl-quinoline-4-carbonyl)amino]thiophene-2-carboxylic acid isopropyl ester Formula: C27H23N3O3S MolecularWeight: 469.55482

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C#N)NC(=O)C2=C(C(=NC3=CC=CC=C32)C4=CC=CC=C4)C)C(=O)OC(C)C

Isomeric SMILES

CC1=C(SC(=C1C#N)NC(=O)C2=C(C(=NC3=CC=CC=C32)C4=CC=CC=C4)C)C(=O)OC(C)C

InChI

InChI=1S/C27H23N3O3S/c1-15(2)33-27(32)24-16(3)20(14-28)26(34-24)30-25(31)22-17(4)23(18-10-6-5-7-11-18)29-21-13-9-8-12-19(21)22/h5-13,15H,1-4H3,(H,30,31)