2-[1-(4-methylphenyl)-1-oxidanylidene-propan-2-yl]sulfanyl-3-prop-2-enyl-quinazolin-4-one

Systemtic Name: 2-[1-(4-methylphenyl)-1-oxidanylidene-propan-2-yl]sulfanyl-3-prop-2-enyl-quinazolin-4-one Openeye Name: 3-allyl-2-[1-methyl-2-oxo-2-(p-tolyl)ethyl]sulfanyl-quinazolin-4-one CAS Name: 2-[[1-(4-methylphenyl)-1-oxopropan-2-yl]thio]-3-prop-2-enyl-4-quinazolinone IUPAC Name: 2-[1-(4-methylphenyl)-1-oxopropan-2-yl]sulfanyl-3-prop-2-enylquinazolin-4-one Traditional Name: 3-allyl-2-[[2-keto-1-methyl-2-(p-tolyl)ethyl]thio]quinazolin-4-one Formula: C21H20N2O2S MolecularWeight: 364.4607

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C(C)SC2=NC3=CC=CC=C3C(=O)N2CC=C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C(C)SC2=NC3=CC=CC=C3C(=O)N2CC=C

InChI

InChI=1S/C21H20N2O2S/c1-4-13-23-20(25)17-7-5-6-8-18(17)22-21(23)26-15(3)19(24)16-11-9-14(2)10-12-16/h4-12,15H,1,13H2,2-3H3