methyl 2-[[2-(1,3-dimethylpyrazol-4-yl)quinolin-4-yl]carbonylamino]-5-methyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[[2-(1,3-dimethylpyrazol-4-yl)quinolin-4-yl]carbonylamino]-5-methyl-thiophene-3-carboxylate Openeye Name: methyl 2-[[2-(1,3-dimethylpyrazol-4-yl)quinoline-4-carbonyl]amino]-5-methyl-thiophene-3-carboxylate CAS Name: 2-[[[2-(1,3-dimethyl-4-pyrazolyl)-4-quinolinyl]-oxomethyl]amino]-5-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[[2-(1,3-dimethylpyrazol-4-yl)quinoline-4-carbonyl]amino]-5-methylthiophene-3-carboxylate Traditional Name: 2-[[2-(1,3-dimethylpyrazol-4-yl)quinoline-4-carbonyl]amino]-5-methyl-thiophene-3-carboxylic acid methyl ester Formula: C22H20N4O3S MolecularWeight: 420.4842

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CN(N=C4C)C)C(=O)OC

Isomeric SMILES

CC1=CC(=C(S1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CN(N=C4C)C)C(=O)OC

InChI

InChI=1S/C22H20N4O3S/c1-12-9-16(22(28)29-4)21(30-12)24-20(27)15-10-19(17-11-26(3)25-13(17)2)23-18-8-6-5-7-14(15)18/h5-11H,1-4H3,(H,24,27)