ethyl 4-(4-chlorophenyl)carbonylsulfanyl-6-oxidanylidene-1,3-diphenyl-2-sulfanylidene-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-(4-chlorophenyl)carbonylsulfanyl-6-oxidanylidene-1,3-diphenyl-2-sulfanylidene-pyrimidine-5-carboxylate Openeye Name: ethyl 4-(4-chlorobenzoyl)sulfanyl-6-oxo-1,3-diphenyl-2-thioxo-pyrimidine-5-carboxylate CAS Name: 4-[[(4-chlorophenyl)-oxomethyl]thio]-6-oxo-1,3-diphenyl-2-sulfanylidene-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-chlorobenzoyl)sulfanyl-6-oxo-1,3-diphenyl-2-sulfanylidenepyrimidine-5-carboxylate Traditional Name: 4-[(4-chlorobenzoyl)thio]-6-keto-1,3-diphenyl-2-thioxo-pyrimidine-5-carboxylic acid ethyl ester Formula: C26H19ClN2O4S2 MolecularWeight: 523.02306

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=S)N(C1=O)C2=CC=CC=C2)C3=CC=CC=C3)SC(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

CCOC(=O)C1=C(N(C(=S)N(C1=O)C2=CC=CC=C2)C3=CC=CC=C3)SC(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C26H19ClN2O4S2/c1-2-33-24(31)21-22(30)28(19-9-5-3-6-10-19)26(34)29(20-11-7-4-8-12-20)23(21)35-25(32)17-13-15-18(27)16-14-17/h3-16H,2H2,1H3