2-methoxyethyl 5-methyl-2-[[(3-methylsulfanylphenyl)amino]methyl]-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: 2-methoxyethyl 5-methyl-2-[[(3-methylsulfanylphenyl)amino]methyl]-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: 2-methoxyethyl 5-methyl-2-[(3-methylsulfanylanilino)methyl]-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-2-[[3-(methylthio)anilino]methyl]-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl 5-methyl-2-[(3-methylsulfanylanilino)methyl]-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-keto-5-methyl-2-[[3-(methylthio)anilino]methyl]-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid 2-methoxyethyl ester Formula: C19H21N3O4S2 MolecularWeight: 419.51774

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)NC(=N2)CNC3=CC(=CC=C3)SC)C(=O)OCCOC

Isomeric SMILES

CC1=C(SC2=C1C(=O)NC(=N2)CNC3=CC(=CC=C3)SC)C(=O)OCCOC

InChI

InChI=1S/C19H21N3O4S2/c1-11-15-17(23)21-14(10-20-12-5-4-6-13(9-12)27-3)22-18(15)28-16(11)19(24)26-8-7-25-2/h4-6,9,20H,7-8,10H2,1-3H3,(H,21,22,23)