3-(3-oxidanylpropyl)-2-[2-(4-propoxyphenoxy)ethylsulfanyl]quinazolin-4-one

Systemtic Name: 3-(3-oxidanylpropyl)-2-[2-(4-propoxyphenoxy)ethylsulfanyl]quinazolin-4-one Openeye Name: 3-(3-hydroxypropyl)-2-[2-(4-propoxyphenoxy)ethylsulfanyl]quinazolin-4-one CAS Name: 3-(3-hydroxypropyl)-2-[2-(4-propoxyphenoxy)ethylthio]-4-quinazolinone IUPAC Name: 3-(3-hydroxypropyl)-2-[2-(4-propoxyphenoxy)ethylsulfanyl]quinazolin-4-one Traditional Name: 3-(3-hydroxypropyl)-2-[2-(4-propoxyphenoxy)ethylthio]quinazolin-4-one Formula: C22H26N2O4S MolecularWeight: 414.51784

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)OCCSC2=NC3=CC=CC=C3C(=O)N2CCCO

Isomeric SMILES

CCCOC1=CC=C(C=C1)OCCSC2=NC3=CC=CC=C3C(=O)N2CCCO

InChI

InChI=1S/C22H26N2O4S/c1-2-14-27-17-8-10-18(11-9-17)28-15-16-29-22-23-20-7-4-3-6-19(20)21(26)24(22)12-5-13-25/h3-4,6-11,25H,2,5,12-16H2,1H3