ethyl 4-(4-chlorophenyl)sulfanyl-2-thiophen-2-yl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-(4-chlorophenyl)sulfanyl-2-thiophen-2-yl-pyrimidine-5-carboxylate Openeye Name: ethyl 4-(4-chlorophenyl)sulfanyl-2-(2-thienyl)pyrimidine-5-carboxylate CAS Name: 4-[(4-chlorophenyl)thio]-2-thiophen-2-yl-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-chlorophenyl)sulfanyl-2-thiophen-2-ylpyrimidine-5-carboxylate Traditional Name: 4-[(4-chlorophenyl)thio]-2-(2-thienyl)pyrimidine-5-carboxylic acid ethyl ester Formula: C17H13ClN2O2S2 MolecularWeight: 376.88032

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1SC2=CC=C(C=C2)Cl)C3=CC=CS3

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1SC2=CC=C(C=C2)Cl)C3=CC=CS3

InChI

InChI=1S/C17H13ClN2O2S2/c1-2-22-17(21)13-10-19-15(14-4-3-9-23-14)20-16(13)24-12-7-5-11(18)6-8-12/h3-10H,2H2,1H3