ethyl 4-oxidanylidene-1,3-diphenyl-6-propan-2-ylsulfanyl-2-sulfanylidene-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-oxidanylidene-1,3-diphenyl-6-propan-2-ylsulfanyl-2-sulfanylidene-pyrimidine-5-carboxylate Openeye Name: ethyl 4-isopropylsulfanyl-6-oxo-1,3-diphenyl-2-thioxo-pyrimidine-5-carboxylate CAS Name: 4-oxo-1,3-diphenyl-6-(propan-2-ylthio)-2-sulfanylidene-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-oxo-1,3-diphenyl-6-propan-2-ylsulfanyl-2-sulfanylidenepyrimidine-5-carboxylate Traditional Name: 4-(isopropylthio)-6-keto-1,3-diphenyl-2-thioxo-pyrimidine-5-carboxylic acid ethyl ester Formula: C22H22N2O3S2 MolecularWeight: 426.55168

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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(C)C

Isomeric SMILES

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

InChI

InChI=1S/C22H22N2O3S2/c1-4-27-21(26)18-19(25)23(16-11-7-5-8-12-16)22(28)24(20(18)29-15(2)3)17-13-9-6-10-14-17/h5-15H,4H2,1-3H3