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

Systemtic Name: ethyl 4-oxidanylidene-1,3-diphenyl-6-(2-pyrrolidin-1-ylethylsulfanyl)-2-sulfanylidene-pyrimidine-5-carboxylate Openeye Name: ethyl 4-oxo-1,3-diphenyl-6-(2-pyrrolidin-1-ylethylsulfanyl)-2-thioxo-pyrimidine-5-carboxylate CAS Name: 4-oxo-1,3-diphenyl-6-[2-(1-pyrrolidinyl)ethylthio]-2-sulfanylidene-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-oxo-1,3-diphenyl-6-(2-pyrrolidin-1-ylethylsulfanyl)-2-sulfanylidenepyrimidine-5-carboxylate Traditional Name: 4-keto-1,3-diphenyl-6-(2-pyrrolidinoethylthio)-2-thioxo-pyrimidine-5-carboxylic acid ethyl ester Formula: C25H27N3O3S2 MolecularWeight: 481.63018

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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)SCCN4CCCC4

Isomeric SMILES

CCOC(=O)C1=C(N(C(=S)N(C1=O)C2=CC=CC=C2)C3=CC=CC=C3)SCCN4CCCC4

InChI

InChI=1S/C25H27N3O3S2/c1-2-31-24(30)21-22(29)27(19-11-5-3-6-12-19)25(32)28(20-13-7-4-8-14-20)23(21)33-18-17-26-15-9-10-16-26/h3-8,11-14H,2,9-10,15-18H2,1H3