2-[(2S)-1-(2,5-dimethylphenyl)-1-oxidanylidene-propan-2-yl]sulfanyl-3-(4-methylpyridin-2-yl)quinazolin-4-one

Systemtic Name: 2-[(2S)-1-(2,5-dimethylphenyl)-1-oxidanylidene-propan-2-yl]sulfanyl-3-(4-methylpyridin-2-yl)quinazolin-4-one Openeye Name: 2-[(1S)-2-(2,5-dimethylphenyl)-1-methyl-2-oxo-ethyl]sulfanyl-3-(4-methyl-2-pyridyl)quinazolin-4-one CAS Name: 2-[[(2S)-1-(2,5-dimethylphenyl)-1-oxopropan-2-yl]thio]-3-(4-methyl-2-pyridinyl)-4-quinazolinone IUPAC Name: 2-[(2S)-1-(2,5-dimethylphenyl)-1-oxopropan-2-yl]sulfanyl-3-(4-methylpyridin-2-yl)quinazolin-4-one Traditional Name: 2-[[(1S)-2-(2,5-dimethylphenyl)-2-keto-1-methyl-ethyl]thio]-3-(4-methyl-2-pyridyl)quinazolin-4-one Formula: C25H23N3O2S MolecularWeight: 429.53402

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C(=O)C(C)SC2=NC3=CC=CC=C3C(=O)N2C4=NC=CC(=C4)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)C(=O)[C@H](C)SC2=NC3=CC=CC=C3C(=O)N2C4=NC=CC(=C4)C

InChI

InChI=1S/C25H23N3O2S/c1-15-9-10-17(3)20(13-15)23(29)18(4)31-25-27-21-8-6-5-7-19(21)24(30)28(25)22-14-16(2)11-12-26-22/h5-14,18H,1-4H3/t18-/m0/s1