3-(4-methylpyridin-2-yl)-2-(2-oxidanylidenecyclohexyl)sulfanyl-quinazolin-4-one

Systemtic Name: 3-(4-methylpyridin-2-yl)-2-(2-oxidanylidenecyclohexyl)sulfanyl-quinazolin-4-one Openeye Name: 3-(4-methyl-2-pyridyl)-2-(2-oxocyclohexyl)sulfanyl-quinazolin-4-one CAS Name: 3-(4-methyl-2-pyridinyl)-2-[(2-oxocyclohexyl)thio]-4-quinazolinone IUPAC Name: 3-(4-methylpyridin-2-yl)-2-(2-oxocyclohexyl)sulfanylquinazolin-4-one Traditional Name: 2-[(2-ketocyclohexyl)thio]-3-(4-methyl-2-pyridyl)quinazolin-4-one Formula: C20H19N3O2S MolecularWeight: 365.44876

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC=C1)N2C(=O)C3=CC=CC=C3N=C2SC4CCCCC4=O

Isomeric SMILES

CC1=CC(=NC=C1)N2C(=O)C3=CC=CC=C3N=C2SC4CCCCC4=O

InChI

InChI=1S/C20H19N3O2S/c1-13-10-11-21-18(12-13)23-19(25)14-6-2-3-7-15(14)22-20(23)26-17-9-5-4-8-16(17)24/h2-3,6-7,10-12,17H,4-5,8-9H2,1H3