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

Systemtic Name: 2-[1-(4-methylphenyl)-1-oxidanylidene-propan-2-yl]sulfanyl-3-(3-oxidanylpropyl)quinazolin-4-one Openeye Name: 3-(3-hydroxypropyl)-2-[1-methyl-2-oxo-2-(p-tolyl)ethyl]sulfanyl-quinazolin-4-one CAS Name: 3-(3-hydroxypropyl)-2-[[1-(4-methylphenyl)-1-oxopropan-2-yl]thio]-4-quinazolinone IUPAC Name: 3-(3-hydroxypropyl)-2-[1-(4-methylphenyl)-1-oxopropan-2-yl]sulfanylquinazolin-4-one Traditional Name: 3-(3-hydroxypropyl)-2-[[2-keto-1-methyl-2-(p-tolyl)ethyl]thio]quinazolin-4-one Formula: C21H22N2O3S MolecularWeight: 382.47598

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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)N2CCCO

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C(C)SC2=NC3=CC=CC=C3C(=O)N2CCCO

InChI

InChI=1S/C21H22N2O3S/c1-14-8-10-16(11-9-14)19(25)15(2)27-21-22-18-7-4-3-6-17(18)20(26)23(21)12-5-13-24/h3-4,6-11,15,24H,5,12-13H2,1-2H3