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

Systemtic Name: 2-[1-(4-methoxyphenyl)-1-oxidanylidene-propan-2-yl]sulfanyl-3-(3-oxidanylpropyl)quinazolin-4-one Openeye Name: 3-(3-hydroxypropyl)-2-[2-(4-methoxyphenyl)-1-methyl-2-oxo-ethyl]sulfanyl-quinazolin-4-one CAS Name: 3-(3-hydroxypropyl)-2-[[1-(4-methoxyphenyl)-1-oxopropan-2-yl]thio]-4-quinazolinone IUPAC Name: 3-(3-hydroxypropyl)-2-[1-(4-methoxyphenyl)-1-oxopropan-2-yl]sulfanylquinazolin-4-one Traditional Name: 3-(3-hydroxypropyl)-2-[[2-keto-2-(4-methoxyphenyl)-1-methyl-ethyl]thio]quinazolin-4-one Formula: C21H22N2O4S MolecularWeight: 398.47538

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22N2O4S/c1-14(19(25)15-8-10-16(27-2)11-9-15)28-21-22-18-7-4-3-6-17(18)20(26)23(21)12-5-13-24/h3-4,6-11,14,24H,5,12-13H2,1-2H3