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

Systemtic Name: methyl 5-methyl-2-[[2-(1-methylpyrazol-4-yl)quinolin-4-yl]carbonylamino]thiophene-3-carboxylate Openeye Name: methyl 5-methyl-2-[[2-(1-methylpyrazol-4-yl)quinoline-4-carbonyl]amino]thiophene-3-carboxylate CAS Name: 5-methyl-2-[[[2-(1-methyl-4-pyrazolyl)-4-quinolinyl]-oxomethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-methyl-2-[[2-(1-methylpyrazol-4-yl)quinoline-4-carbonyl]amino]thiophene-3-carboxylate Traditional Name: 5-methyl-2-[[2-(1-methylpyrazol-4-yl)quinoline-4-carbonyl]amino]thiophene-3-carboxylic acid methyl ester Formula: C21H18N4O3S MolecularWeight: 406.45762

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H18N4O3S/c1-12-8-16(21(27)28-3)20(29-12)24-19(26)15-9-18(13-10-22-25(2)11-13)23-17-7-5-4-6-14(15)17/h4-11H,1-3H3,(H,24,26)