2-[2-(3-chloranylphenoxy)ethylsulfanyl]-3-(1-oxidanylbutan-2-yl)quinazolin-4-one

Systemtic Name: 2-[2-(3-chloranylphenoxy)ethylsulfanyl]-3-(1-oxidanylbutan-2-yl)quinazolin-4-one Openeye Name: 2-[2-(3-chlorophenoxy)ethylsulfanyl]-3-[1-(hydroxymethyl)propyl]quinazolin-4-one CAS Name: 2-[2-(3-chlorophenoxy)ethylthio]-3-(1-hydroxybutan-2-yl)-4-quinazolinone IUPAC Name: 2-[2-(3-chlorophenoxy)ethylsulfanyl]-3-(1-hydroxybutan-2-yl)quinazolin-4-one Traditional Name: 2-[2-(3-chlorophenoxy)ethylthio]-3-(1-methylolpropyl)quinazolin-4-one Formula: C20H21ClN2O3S MolecularWeight: 404.91034

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)N1C(=O)C2=CC=CC=C2N=C1SCCOC3=CC(=CC=C3)Cl

Isomeric SMILES

CCC(CO)N1C(=O)C2=CC=CC=C2N=C1SCCOC3=CC(=CC=C3)Cl

InChI

InChI=1S/C20H21ClN2O3S/c1-2-15(13-24)23-19(25)17-8-3-4-9-18(17)22-20(23)27-11-10-26-16-7-5-6-14(21)12-16/h3-9,12,15,24H,2,10-11,13H2,1H3