ethyl 5-methyl-4-oxidanylidene-2-(quinazolin-4-ylsulfanylmethyl)-3H-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: ethyl 5-methyl-4-oxidanylidene-2-(quinazolin-4-ylsulfanylmethyl)-3H-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 5-methyl-4-oxo-2-(quinazolin-4-ylsulfanylmethyl)-3H-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-4-oxo-2-[(4-quinazolinylthio)methyl]-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-4-oxo-2-(quinazolin-4-ylsulfanylmethyl)-3H-thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-keto-5-methyl-2-[(quinazolin-4-ylthio)methyl]-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C19H16N4O3S2 MolecularWeight: 412.48534

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(S1)N=C(NC2=O)CSC3=NC=NC4=CC=CC=C43)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(S1)N=C(NC2=O)CSC3=NC=NC4=CC=CC=C43)C

InChI

InChI=1S/C19H16N4O3S2/c1-3-26-19(25)15-10(2)14-16(24)22-13(23-18(14)28-15)8-27-17-11-6-4-5-7-12(11)20-9-21-17/h4-7,9H,3,8H2,1-2H3,(H,22,23,24)