(4-chlorophenyl) 2,5-bis(azanyl)-4-methylsulfanyl-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: (4-chlorophenyl) 2,5-bis(azanyl)-4-methylsulfanyl-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: (4-chlorophenyl) 2,5-diamino-4-methylsulfanyl-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 2,5-diamino-4-(methylthio)-6-thieno[2,3-d]pyrimidinecarboxylic acid (4-chlorophenyl) ester IUPAC Name: (4-chlorophenyl) 2,5-diamino-4-methylsulfanylthieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 2,5-diamino-4-(methylthio)thieno[2,3-d]pyrimidine-6-carboxylic acid (4-chlorophenyl) ester Formula: C14H11ClN4O2S2 MolecularWeight: 366.84574

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=NC2=C1C(=C(S2)C(=O)OC3=CC=C(C=C3)Cl)N)N

Isomeric SMILES

CSC1=NC(=NC2=C1C(=C(S2)C(=O)OC3=CC=C(C=C3)Cl)N)N

InChI

InChI=1S/C14H11ClN4O2S2/c1-22-11-8-9(16)10(23-12(8)19-14(17)18-11)13(20)21-7-4-2-6(15)3-5-7/h2-5H,16H2,1H3,(H2,17,18,19)