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

Systemtic Name: ethyl 5-aminocarbonyl-4-methyl-2-[[2-(1,3,5-trimethylpyrazol-4-yl)quinolin-4-yl]carbonylamino]thiophene-3-carboxylate Openeye Name: ethyl 5-carbamoyl-4-methyl-2-[[2-(1,3,5-trimethylpyrazol-4-yl)quinoline-4-carbonyl]amino]thiophene-3-carboxylate CAS Name: 5-carbamoyl-4-methyl-2-[[oxo-[2-(1,3,5-trimethyl-4-pyrazolyl)-4-quinolinyl]methyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-carbamoyl-4-methyl-2-[[2-(1,3,5-trimethylpyrazol-4-yl)quinoline-4-carbonyl]amino]thiophene-3-carboxylate Traditional Name: 5-carbamoyl-4-methyl-2-[[2-(1,3,5-trimethylpyrazol-4-yl)quinoline-4-carbonyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C25H25N5O4S MolecularWeight: 491.5621

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C25H25N5O4S/c1-6-34-25(33)19-12(2)21(22(26)31)35-24(19)28-23(32)16-11-18(20-13(3)29-30(5)14(20)4)27-17-10-8-7-9-15(16)17/h7-11H,6H2,1-5H3,(H2,26,31)(H,28,32)