2-[2-(2-methylpiperidin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-3-(5-methylpyridin-2-yl)quinazolin-4-one

Systemtic Name: 2-[2-(2-methylpiperidin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-3-(5-methylpyridin-2-yl)quinazolin-4-one Openeye Name: 2-[2-(2-methyl-1-piperidyl)-2-oxo-ethyl]sulfanyl-3-(5-methyl-2-pyridyl)quinazolin-4-one CAS Name: 2-[[2-(2-methyl-1-piperidinyl)-2-oxoethyl]thio]-3-(5-methyl-2-pyridinyl)-4-quinazolinone IUPAC Name: 2-[2-(2-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl-3-(5-methylpyridin-2-yl)quinazolin-4-one Traditional Name: 2-[[2-keto-2-(2-methylpiperidino)ethyl]thio]-3-(5-methyl-2-pyridyl)quinazolin-4-one Formula: C22H24N4O2S MolecularWeight: 408.51656

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1C(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=NC=C(C=C4)C

Isomeric SMILES

CC1CCCCN1C(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=NC=C(C=C4)C

InChI

InChI=1S/C22H24N4O2S/c1-15-10-11-19(23-13-15)26-21(28)17-8-3-4-9-18(17)24-22(26)29-14-20(27)25-12-6-5-7-16(25)2/h3-4,8-11,13,16H,5-7,12,14H2,1-2H3