1,3,5-triphenyl-6-(2-pyrrolidin-1-ylethylsulfanyl)-2-sulfanylidene-pyrimidin-4-one

Systemtic Name: 1,3,5-triphenyl-6-(2-pyrrolidin-1-ylethylsulfanyl)-2-sulfanylidene-pyrimidin-4-one Openeye Name: 1,3,5-triphenyl-6-(2-pyrrolidin-1-ylethylsulfanyl)-2-thioxo-pyrimidin-4-one CAS Name: 1,3,5-triphenyl-6-[2-(1-pyrrolidinyl)ethylthio]-2-sulfanylidene-4-pyrimidinone IUPAC Name: 1,3,5-triphenyl-6-(2-pyrrolidin-1-ylethylsulfanyl)-2-sulfanylidenepyrimidin-4-one Traditional Name: 1,3,5-triphenyl-6-(2-pyrrolidinoethylthio)-2-thioxo-pyrimidin-4-one Formula: C28H27N3OS2 MolecularWeight: 485.66348

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCSC2=C(C(=O)N(C(=S)N2C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CCN(C1)CCSC2=C(C(=O)N(C(=S)N2C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C28H27N3OS2/c32-26-25(22-12-4-1-5-13-22)27(34-21-20-29-18-10-11-19-29)31(24-16-8-3-9-17-24)28(33)30(26)23-14-6-2-7-15-23/h1-9,12-17H,10-11,18-21H2