3-(2-methylphenyl)-2-[(2R)-1-oxidanylidene-1-piperidin-1-yl-propan-2-yl]sulfanyl-quinazolin-4-one

Systemtic Name: 3-(2-methylphenyl)-2-[(2R)-1-oxidanylidene-1-piperidin-1-yl-propan-2-yl]sulfanyl-quinazolin-4-one Openeye Name: 2-[(1R)-1-methyl-2-oxo-2-(1-piperidyl)ethyl]sulfanyl-3-(o-tolyl)quinazolin-4-one CAS Name: 3-(2-methylphenyl)-2-[[(2R)-1-oxo-1-(1-piperidinyl)propan-2-yl]thio]-4-quinazolinone IUPAC Name: 3-(2-methylphenyl)-2-[(2R)-1-oxo-1-piperidin-1-ylpropan-2-yl]sulfanylquinazolin-4-one Traditional Name: 2-[[(1R)-2-keto-1-methyl-2-piperidino-ethyl]thio]-3-(o-tolyl)quinazolin-4-one Formula: C23H25N3O2S MolecularWeight: 407.5285

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=O)C3=CC=CC=C3N=C2SC(C)C(=O)N4CCCCC4

Isomeric SMILES

CC1=CC=CC=C1N2C(=O)C3=CC=CC=C3N=C2S[C@H](C)C(=O)N4CCCCC4

InChI

InChI=1S/C23H25N3O2S/c1-16-10-4-7-13-20(16)26-22(28)18-11-5-6-12-19(18)24-23(26)29-17(2)21(27)25-14-8-3-9-15-25/h4-7,10-13,17H,3,8-9,14-15H2,1-2H3/t17-/m1/s1