ethyl 5-methyl-2-[1-[(3-methylsulfanylphenyl)amino]ethyl]-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: ethyl 5-methyl-2-[1-[(3-methylsulfanylphenyl)amino]ethyl]-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 5-methyl-2-[1-(3-methylsulfanylanilino)ethyl]-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-2-[1-[3-(methylthio)anilino]ethyl]-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-2-[1-(3-methylsulfanylanilino)ethyl]-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-keto-5-methyl-2-[1-[3-(methylthio)anilino]ethyl]-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C19H21N3O3S2 MolecularWeight: 403.51834

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(S1)N=C(NC2=O)C(C)NC3=CC(=CC=C3)SC)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(S1)N=C(NC2=O)C(C)NC3=CC(=CC=C3)SC)C

InChI

InChI=1S/C19H21N3O3S2/c1-5-25-19(24)15-10(2)14-17(23)21-16(22-18(14)27-15)11(3)20-12-7-6-8-13(9-12)26-4/h6-9,11,20H,5H2,1-4H3,(H,21,22,23)