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

Systemtic Name: ethyl 5-azanyl-2-(2-ethoxy-2-oxidanylidene-ethyl)sulfanyl-4-phenyl-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 5-amino-2-(2-ethoxy-2-oxo-ethyl)sulfanyl-4-phenyl-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-amino-2-[(2-ethoxy-2-oxoethyl)thio]-4-phenyl-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-2-(2-ethoxy-2-oxoethyl)sulfanyl-4-phenylthieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 5-amino-2-[(2-ethoxy-2-keto-ethyl)thio]-4-phenyl-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C19H19N3O4S2 MolecularWeight: 417.50186

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=NC(=C2C(=C(SC2=N1)C(=O)OCC)N)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)CSC1=NC(=C2C(=C(SC2=N1)C(=O)OCC)N)C3=CC=CC=C3

InChI

InChI=1S/C19H19N3O4S2/c1-3-25-12(23)10-27-19-21-15(11-8-6-5-7-9-11)13-14(20)16(18(24)26-4-2)28-17(13)22-19/h5-9H,3-4,10,20H2,1-2H3