6-[(4-methylphenyl)sulfanylmethyl]-2-[2-oxidanylidene-2-(2,2,4-trimethyl-4-phenyl-3H-quinolin-1-yl)ethyl]sulfanyl-1H-pyrimidin-4-one

Systemtic Name: 6-[(4-methylphenyl)sulfanylmethyl]-2-[2-oxidanylidene-2-(2,2,4-trimethyl-4-phenyl-3H-quinolin-1-yl)ethyl]sulfanyl-1H-pyrimidin-4-one Openeye Name: 2-[2-oxo-2-(2,2,4-trimethyl-4-phenyl-3H-quinolin-1-yl)ethyl]sulfanyl-6-(p-tolylsulfanylmethyl)-1H-pyrimidin-4-one CAS Name: 6-[[(4-methylphenyl)thio]methyl]-2-[[2-oxo-2-(2,2,4-trimethyl-4-phenyl-3H-quinolin-1-yl)ethyl]thio]-1H-pyrimidin-4-one IUPAC Name: 6-[(4-methylphenyl)sulfanylmethyl]-2-[2-oxo-2-(2,2,4-trimethyl-4-phenyl-3H-quinolin-1-yl)ethyl]sulfanyl-1H-pyrimidin-4-one Traditional Name: 2-[[2-keto-2-(2,2,4-trimethyl-4-phenyl-3H-quinolin-1-yl)ethyl]thio]-6-[(p-tolylthio)methyl]-1H-pyrimidin-4-one Formula: C32H33N3O2S2 MolecularWeight: 555.75332

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCC2=CC(=O)N=C(N2)SCC(=O)N3C4=CC=CC=C4C(CC3(C)C)(C)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)SCC2=CC(=O)N=C(N2)SCC(=O)N3C4=CC=CC=C4C(CC3(C)C)(C)C5=CC=CC=C5

InChI

InChI=1S/C32H33N3O2S2/c1-22-14-16-25(17-15-22)38-19-24-18-28(36)34-30(33-24)39-20-29(37)35-27-13-9-8-12-26(27)32(4,21-31(35,2)3)23-10-6-5-7-11-23/h5-18H,19-21H2,1-4H3,(H,33,34,36)