diethyl 3-methyl-5-[[2-(1,3,5-trimethylpyrazol-4-yl)quinolin-4-yl]carbonylamino]thiophene-2,4-dicarboxylate

Systemtic Name: diethyl 3-methyl-5-[[2-(1,3,5-trimethylpyrazol-4-yl)quinolin-4-yl]carbonylamino]thiophene-2,4-dicarboxylate Openeye Name: diethyl 3-methyl-5-[[2-(1,3,5-trimethylpyrazol-4-yl)quinoline-4-carbonyl]amino]thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[oxo-[2-(1,3,5-trimethyl-4-pyrazolyl)-4-quinolinyl]methyl]amino]thiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 3-methyl-5-[[2-(1,3,5-trimethylpyrazol-4-yl)quinoline-4-carbonyl]amino]thiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-[[2-(1,3,5-trimethylpyrazol-4-yl)quinoline-4-carbonyl]amino]thiophene-2,4-dicarboxylic acid diethyl ester Formula: C27H28N4O5S MolecularWeight: 520.60002

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=C(N(N=C4C)C)C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=C(N(N=C4C)C)C

InChI

InChI=1S/C27H28N4O5S/c1-7-35-26(33)21-14(3)23(27(34)36-8-2)37-25(21)29-24(32)18-13-20(22-15(4)30-31(6)16(22)5)28-19-12-10-9-11-17(18)19/h9-13H,7-8H2,1-6H3,(H,29,32)