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

Systemtic Name: 3-[(4-methylphenyl)methyl]-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-(p-tolylmethyl)quinazolin-4-one CAS Name: 3-[(4-methylphenyl)methyl]-2-[[(2R)-1-oxo-1-(1-piperidinyl)propan-2-yl]thio]-4-quinazolinone IUPAC Name: 3-[(4-methylphenyl)methyl]-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-(4-methylbenzyl)quinazolin-4-one Formula: C24H27N3O2S MolecularWeight: 421.55508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3N=C2SC(C)C(=O)N4CCCCC4

Isomeric SMILES

CC1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3N=C2S[C@H](C)C(=O)N4CCCCC4

InChI

InChI=1S/C24H27N3O2S/c1-17-10-12-19(13-11-17)16-27-23(29)20-8-4-5-9-21(20)25-24(27)30-18(2)22(28)26-14-6-3-7-15-26/h4-5,8-13,18H,3,6-7,14-16H2,1-2H3/t18-/m1/s1