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

Systemtic Name: methyl 5-aminocarbonyl-4-methyl-2-[[2-(1-methylpyrazol-4-yl)quinolin-4-yl]carbonylamino]thiophene-3-carboxylate Openeye Name: methyl 5-carbamoyl-4-methyl-2-[[2-(1-methylpyrazol-4-yl)quinoline-4-carbonyl]amino]thiophene-3-carboxylate CAS Name: 5-carbamoyl-4-methyl-2-[[[2-(1-methyl-4-pyrazolyl)-4-quinolinyl]-oxomethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-carbamoyl-4-methyl-2-[[2-(1-methylpyrazol-4-yl)quinoline-4-carbonyl]amino]thiophene-3-carboxylate Traditional Name: 5-carbamoyl-4-methyl-2-[[2-(1-methylpyrazol-4-yl)quinoline-4-carbonyl]amino]thiophene-3-carboxylic acid methyl ester Formula: C22H19N5O4S MolecularWeight: 449.48236

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H19N5O4S/c1-11-17(22(30)31-3)21(32-18(11)19(23)28)26-20(29)14-8-16(12-9-24-27(2)10-12)25-15-7-5-4-6-13(14)15/h4-10H,1-3H3,(H2,23,28)(H,26,29)