ethyl 3-methyl-5-[(2-thiophen-2-ylquinolin-4-yl)carbonylamino]thiophene-2-carboxylate

Systemtic Name: ethyl 3-methyl-5-[(2-thiophen-2-ylquinolin-4-yl)carbonylamino]thiophene-2-carboxylate Openeye Name: ethyl 3-methyl-5-[[2-(2-thienyl)quinoline-4-carbonyl]amino]thiophene-2-carboxylate CAS Name: 3-methyl-5-[[oxo-(2-thiophen-2-yl-4-quinolinyl)methyl]amino]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 3-methyl-5-[(2-thiophen-2-ylquinoline-4-carbonyl)amino]thiophene-2-carboxylate Traditional Name: 3-methyl-5-[[2-(2-thienyl)quinoline-4-carbonyl]amino]thiophene-2-carboxylic acid ethyl ester Formula: C22H18N2O3S2 MolecularWeight: 422.51992

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(S1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CS4)C

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CS4)C

InChI

InChI=1S/C22H18N2O3S2/c1-3-27-22(26)20-13(2)11-19(29-20)24-21(25)15-12-17(18-9-6-10-28-18)23-16-8-5-4-7-14(15)16/h4-12H,3H2,1-2H3,(H,24,25)