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

Systemtic Name: 2-[1-(3-chlorophenyl)-1-oxidanylidene-propan-2-yl]sulfanyl-3-(3-oxidanylpropyl)quinazolin-4-one Openeye Name: 2-[2-(3-chlorophenyl)-1-methyl-2-oxo-ethyl]sulfanyl-3-(3-hydroxypropyl)quinazolin-4-one CAS Name: 2-[[1-(3-chlorophenyl)-1-oxopropan-2-yl]thio]-3-(3-hydroxypropyl)-4-quinazolinone IUPAC Name: 2-[1-(3-chlorophenyl)-1-oxopropan-2-yl]sulfanyl-3-(3-hydroxypropyl)quinazolin-4-one Traditional Name: 2-[[2-(3-chlorophenyl)-2-keto-1-methyl-ethyl]thio]-3-(3-hydroxypropyl)quinazolin-4-one Formula: C20H19ClN2O3S MolecularWeight: 402.89446

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H19ClN2O3S/c1-13(18(25)14-6-4-7-15(21)12-14)27-20-22-17-9-3-2-8-16(17)19(26)23(20)10-5-11-24/h2-4,6-9,12-13,24H,5,10-11H2,1H3