2-[1-(3,5-dimethylpiperidin-1-yl)-1-oxidanylidene-propan-2-yl]sulfanyl-3-(pyridin-3-ylmethyl)quinazolin-4-one

Systemtic Name: 2-[1-(3,5-dimethylpiperidin-1-yl)-1-oxidanylidene-propan-2-yl]sulfanyl-3-(pyridin-3-ylmethyl)quinazolin-4-one Openeye Name: 2-[2-(3,5-dimethyl-1-piperidyl)-1-methyl-2-oxo-ethyl]sulfanyl-3-(3-pyridylmethyl)quinazolin-4-one CAS Name: 2-[[1-(3,5-dimethyl-1-piperidinyl)-1-oxopropan-2-yl]thio]-3-(3-pyridinylmethyl)-4-quinazolinone IUPAC Name: 2-[1-(3,5-dimethylpiperidin-1-yl)-1-oxopropan-2-yl]sulfanyl-3-(pyridin-3-ylmethyl)quinazolin-4-one Traditional Name: 2-[[2-(3,5-dimethylpiperidino)-2-keto-1-methyl-ethyl]thio]-3-(3-pyridylmethyl)quinazolin-4-one Formula: C24H28N4O2S MolecularWeight: 436.56972

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C(=O)C(C)SC2=NC3=CC=CC=C3C(=O)N2CC4=CN=CC=C4)C

Isomeric SMILES

CC1CC(CN(C1)C(=O)C(C)SC2=NC3=CC=CC=C3C(=O)N2CC4=CN=CC=C4)C

InChI

InChI=1S/C24H28N4O2S/c1-16-11-17(2)14-27(13-16)22(29)18(3)31-24-26-21-9-5-4-8-20(21)23(30)28(24)15-19-7-6-10-25-12-19/h4-10,12,16-18H,11,13-15H2,1-3H3