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

Systemtic Name: 6-methyl-2-[2-oxidanylidene-2-[(4S)-2,2,4-trimethyl-4-phenyl-3H-quinolin-1-yl]ethyl]sulfanyl-1H-pyrimidin-4-one Openeye Name: 6-methyl-2-[2-oxo-2-[(4S)-2,2,4-trimethyl-4-phenyl-3H-quinolin-1-yl]ethyl]sulfanyl-1H-pyrimidin-4-one CAS Name: 6-methyl-2-[[2-oxo-2-[(4S)-2,2,4-trimethyl-4-phenyl-3H-quinolin-1-yl]ethyl]thio]-1H-pyrimidin-4-one IUPAC Name: 6-methyl-2-[2-oxo-2-[(4S)-2,2,4-trimethyl-4-phenyl-3H-quinolin-1-yl]ethyl]sulfanyl-1H-pyrimidin-4-one Traditional Name: 2-[[2-keto-2-[(4S)-2,2,4-trimethyl-4-phenyl-3H-quinolin-1-yl]ethyl]thio]-6-methyl-1H-pyrimidin-4-one Formula: C25H27N3O2S MolecularWeight: 433.56578

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N=C(N1)SCC(=O)N2C3=CC=CC=C3C(CC2(C)C)(C)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=O)N=C(N1)SCC(=O)N2C3=CC=CC=C3[C@](CC2(C)C)(C)C4=CC=CC=C4

InChI

InChI=1S/C25H27N3O2S/c1-17-14-21(29)27-23(26-17)31-15-22(30)28-20-13-9-8-12-19(20)25(4,16-24(28,2)3)18-10-6-5-7-11-18/h5-14H,15-16H2,1-4H3,(H,26,27,29)/t25-/m0/s1