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

Systemtic Name: 3-cyclopropyl-2-[(2S)-1-(3,4-dimethylphenyl)-1-oxidanylidene-propan-2-yl]sulfanyl-quinazolin-4-one Openeye Name: 3-cyclopropyl-2-[(1S)-2-(3,4-dimethylphenyl)-1-methyl-2-oxo-ethyl]sulfanyl-quinazolin-4-one CAS Name: 3-cyclopropyl-2-[[(2S)-1-(3,4-dimethylphenyl)-1-oxopropan-2-yl]thio]-4-quinazolinone IUPAC Name: 3-cyclopropyl-2-[(2S)-1-(3,4-dimethylphenyl)-1-oxopropan-2-yl]sulfanylquinazolin-4-one Traditional Name: 3-cyclopropyl-2-[[(1S)-2-(3,4-dimethylphenyl)-2-keto-1-methyl-ethyl]thio]quinazolin-4-one Formula: C22H22N2O2S MolecularWeight: 378.48728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)C(C)SC2=NC3=CC=CC=C3C(=O)N2C4CC4)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)[C@H](C)SC2=NC3=CC=CC=C3C(=O)N2C4CC4)C

InChI

InChI=1S/C22H22N2O2S/c1-13-8-9-16(12-14(13)2)20(25)15(3)27-22-23-19-7-5-4-6-18(19)21(26)24(22)17-10-11-17/h4-9,12,15,17H,10-11H2,1-3H3/t15-/m0/s1