phenyl 5-azanyl-2-methylsulfanyl-4-phenyl-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: phenyl 5-azanyl-2-methylsulfanyl-4-phenyl-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: phenyl 5-amino-2-methylsulfanyl-4-phenyl-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-amino-2-(methylthio)-4-phenyl-6-thieno[2,3-d]pyrimidinecarboxylic acid phenyl ester IUPAC Name: phenyl 5-amino-2-methylsulfanyl-4-phenylthieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 5-amino-2-(methylthio)-4-phenyl-thieno[2,3-d]pyrimidine-6-carboxylic acid phenyl ester Formula: C20H15N3O2S2 MolecularWeight: 393.482

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=C2C(=C(SC2=N1)C(=O)OC3=CC=CC=C3)N)C4=CC=CC=C4

Isomeric SMILES

CSC1=NC(=C2C(=C(SC2=N1)C(=O)OC3=CC=CC=C3)N)C4=CC=CC=C4

InChI

InChI=1S/C20H15N3O2S2/c1-26-20-22-16(12-8-4-2-5-9-12)14-15(21)17(27-18(14)23-20)19(24)25-13-10-6-3-7-11-13/h2-11H,21H2,1H3