ethyl 4-(2-chloranyl-7-methyl-quinolin-3-yl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-(2-chloranyl-7-methyl-quinolin-3-yl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 4-(2-chloro-7-methyl-3-quinolyl)-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 4-(2-chloro-7-methyl-3-quinolinyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(2-chloro-7-methylquinolin-3-yl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 4-(2-chloro-7-methyl-3-quinolyl)-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C18H18ClN3O2S MolecularWeight: 375.87242

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=S)NC1C2=C(N=C3C=C(C=CC3=C2)C)Cl)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=S)NC1C2=C(N=C3C=C(C=CC3=C2)C)Cl)C

InChI

InChI=1S/C18H18ClN3O2S/c1-4-24-17(23)14-10(3)20-18(25)22-15(14)12-8-11-6-5-9(2)7-13(11)21-16(12)19/h5-8,15H,4H2,1-3H3,(H2,20,22,25)