ethyl 4-(4-acetamidophenyl)sulfanyl-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: ethyl 4-(4-acetamidophenyl)sulfanyl-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 4-(4-acetamidophenyl)sulfanyl-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 4-[(4-acetamidophenyl)thio]-5-methyl-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-acetamidophenyl)sulfanyl-5-methylthieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-[(4-acetamidophenyl)thio]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C18H17N3O3S2 MolecularWeight: 387.47588

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(S1)N=CN=C2SC3=CC=C(C=C3)NC(=O)C)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(S1)N=CN=C2SC3=CC=C(C=C3)NC(=O)C)C

InChI

InChI=1S/C18H17N3O3S2/c1-4-24-18(23)15-10(2)14-16(19-9-20-17(14)26-15)25-13-7-5-12(6-8-13)21-11(3)22/h5-9H,4H2,1-3H3,(H,21,22)