dipropan-2-yl 3-methyl-5-[(2-phenylquinolin-4-yl)carbonylamino]thiophene-2,4-dicarboxylate

Systemtic Name: dipropan-2-yl 3-methyl-5-[(2-phenylquinolin-4-yl)carbonylamino]thiophene-2,4-dicarboxylate Openeye Name: diisopropyl 3-methyl-5-[(2-phenylquinoline-4-carbonyl)amino]thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[oxo-(2-phenyl-4-quinolinyl)methyl]amino]thiophene-2,4-dicarboxylic acid dipropan-2-yl ester IUPAC Name: dipropan-2-yl 3-methyl-5-[(2-phenylquinoline-4-carbonyl)amino]thiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-[(2-phenylquinoline-4-carbonyl)amino]thiophene-2,4-dicarboxylic acid diisopropyl ester Formula: C29H28N2O5S MolecularWeight: 516.60802

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H28N2O5S/c1-16(2)35-28(33)24-18(5)25(29(34)36-17(3)4)37-27(24)31-26(32)21-15-23(19-11-7-6-8-12-19)30-22-14-10-9-13-20(21)22/h6-17H,1-5H3,(H,31,32)