3-(5-methylpyridin-2-yl)-2-(phenylmethylsulfanyl)quinazolin-4-one

Systemtic Name: 3-(5-methylpyridin-2-yl)-2-(phenylmethylsulfanyl)quinazolin-4-one Openeye Name: 2-benzylsulfanyl-3-(5-methyl-2-pyridyl)quinazolin-4-one CAS Name: 3-(5-methyl-2-pyridinyl)-2-(phenylmethylthio)-4-quinazolinone IUPAC Name: 2-benzylsulfanyl-3-(5-methylpyridin-2-yl)quinazolin-4-one Traditional Name: 2-(benzylthio)-3-(5-methyl-2-pyridyl)quinazolin-4-one Formula: C21H17N3OS MolecularWeight: 359.44418

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC4=CC=CC=C4

Isomeric SMILES

CC1=CN=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC4=CC=CC=C4

InChI

InChI=1S/C21H17N3OS/c1-15-11-12-19(22-13-15)24-20(25)17-9-5-6-10-18(17)23-21(24)26-14-16-7-3-2-4-8-16/h2-13H,14H2,1H3