2-[2-(4-methoxyphenyl)ethylsulfanyl]-3-(4-methylpyridin-2-yl)quinazolin-4-one

Systemtic Name: 2-[2-(4-methoxyphenyl)ethylsulfanyl]-3-(4-methylpyridin-2-yl)quinazolin-4-one Openeye Name: 2-[2-(4-methoxyphenyl)ethylsulfanyl]-3-(4-methyl-2-pyridyl)quinazolin-4-one CAS Name: 2-[2-(4-methoxyphenyl)ethylthio]-3-(4-methyl-2-pyridinyl)-4-quinazolinone IUPAC Name: 2-[2-(4-methoxyphenyl)ethylsulfanyl]-3-(4-methylpyridin-2-yl)quinazolin-4-one Traditional Name: 2-[2-(4-methoxyphenyl)ethylthio]-3-(4-methyl-2-pyridyl)quinazolin-4-one Formula: C23H21N3O2S MolecularWeight: 403.49674

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC=C1)N2C(=O)C3=CC=CC=C3N=C2SCCC4=CC=C(C=C4)OC

Isomeric SMILES

CC1=CC(=NC=C1)N2C(=O)C3=CC=CC=C3N=C2SCCC4=CC=C(C=C4)OC

InChI

InChI=1S/C23H21N3O2S/c1-16-11-13-24-21(15-16)26-22(27)19-5-3-4-6-20(19)25-23(26)29-14-12-17-7-9-18(28-2)10-8-17/h3-11,13,15H,12,14H2,1-2H3