ethyl 5-azanyl-4-[(2-ethoxy-2-oxidanylidene-ethyl)amino]-2-methylsulfanyl-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: ethyl 5-azanyl-4-[(2-ethoxy-2-oxidanylidene-ethyl)amino]-2-methylsulfanyl-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 5-amino-4-[(2-ethoxy-2-oxo-ethyl)amino]-2-methylsulfanyl-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-amino-4-[(2-ethoxy-2-oxoethyl)amino]-2-(methylthio)-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-4-[(2-ethoxy-2-oxoethyl)amino]-2-methylsulfanylthieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 5-amino-4-[(2-ethoxy-2-keto-ethyl)amino]-2-(methylthio)thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C14H18N4O4S2 MolecularWeight: 370.44712

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CNC1=C2C(=C(SC2=NC(=N1)SC)C(=O)OCC)N

Isomeric SMILES

CCOC(=O)CNC1=C2C(=C(SC2=NC(=N1)SC)C(=O)OCC)N

InChI

InChI=1S/C14H18N4O4S2/c1-4-21-7(19)6-16-11-8-9(15)10(13(20)22-5-2)24-12(8)18-14(17-11)23-3/h4-6,15H2,1-3H3,(H,16,17,18)