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

Systemtic Name: 3-(2,3-dimethylphenyl)-2-[(2S)-1-oxidanylidene-1-piperidin-1-yl-propan-2-yl]sulfanyl-quinazolin-4-one Openeye Name: 3-(2,3-dimethylphenyl)-2-[(1S)-1-methyl-2-oxo-2-(1-piperidyl)ethyl]sulfanyl-quinazolin-4-one CAS Name: 3-(2,3-dimethylphenyl)-2-[[(2S)-1-oxo-1-(1-piperidinyl)propan-2-yl]thio]-4-quinazolinone IUPAC Name: 3-(2,3-dimethylphenyl)-2-[(2S)-1-oxo-1-piperidin-1-ylpropan-2-yl]sulfanylquinazolin-4-one Traditional Name: 3-(2,3-dimethylphenyl)-2-[[(1S)-2-keto-1-methyl-2-piperidino-ethyl]thio]quinazolin-4-one Formula: C24H27N3O2S MolecularWeight: 421.55508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2C(=O)C3=CC=CC=C3N=C2SC(C)C(=O)N4CCCCC4)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2C(=O)C3=CC=CC=C3N=C2S[C@@H](C)C(=O)N4CCCCC4)C

InChI

InChI=1S/C24H27N3O2S/c1-16-10-9-13-21(17(16)2)27-23(29)19-11-5-6-12-20(19)25-24(27)30-18(3)22(28)26-14-7-4-8-15-26/h5-6,9-13,18H,4,7-8,14-15H2,1-3H3/t18-/m0/s1