2-[2-oxidanylidene-2-(4-propylphenyl)ethyl]sulfanyl-3-(3-oxidanylpropyl)quinazolin-4-one

Systemtic Name: 2-[2-oxidanylidene-2-(4-propylphenyl)ethyl]sulfanyl-3-(3-oxidanylpropyl)quinazolin-4-one Openeye Name: 3-(3-hydroxypropyl)-2-[2-oxo-2-(4-propylphenyl)ethyl]sulfanyl-quinazolin-4-one CAS Name: 3-(3-hydroxypropyl)-2-[[2-oxo-2-(4-propylphenyl)ethyl]thio]-4-quinazolinone IUPAC Name: 3-(3-hydroxypropyl)-2-[2-oxo-2-(4-propylphenyl)ethyl]sulfanylquinazolin-4-one Traditional Name: 3-(3-hydroxypropyl)-2-[[2-keto-2-(4-propylphenyl)ethyl]thio]quinazolin-4-one Formula: C22H24N2O3S MolecularWeight: 396.50256

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2CCCO

Isomeric SMILES

CCCC1=CC=C(C=C1)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2CCCO

InChI

InChI=1S/C22H24N2O3S/c1-2-6-16-9-11-17(12-10-16)20(26)15-28-22-23-19-8-4-3-7-18(19)21(27)24(22)13-5-14-25/h3-4,7-12,25H,2,5-6,13-15H2,1H3