2-[2-(2,6-dimethylphenoxy)ethylsulfanyl]-3-(3-oxidanylpropyl)quinazolin-4-one

Systemtic Name: 2-[2-(2,6-dimethylphenoxy)ethylsulfanyl]-3-(3-oxidanylpropyl)quinazolin-4-one Openeye Name: 2-[2-(2,6-dimethylphenoxy)ethylsulfanyl]-3-(3-hydroxypropyl)quinazolin-4-one CAS Name: 2-[2-(2,6-dimethylphenoxy)ethylthio]-3-(3-hydroxypropyl)-4-quinazolinone IUPAC Name: 2-[2-(2,6-dimethylphenoxy)ethylsulfanyl]-3-(3-hydroxypropyl)quinazolin-4-one Traditional Name: 2-[2-(2,6-dimethylphenoxy)ethylthio]-3-(3-hydroxypropyl)quinazolin-4-one Formula: C21H24N2O3S MolecularWeight: 384.49186

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OCCSC2=NC3=CC=CC=C3C(=O)N2CCCO

Isomeric SMILES

CC1=C(C(=CC=C1)C)OCCSC2=NC3=CC=CC=C3C(=O)N2CCCO

InChI

InChI=1S/C21H24N2O3S/c1-15-7-5-8-16(2)19(15)26-13-14-27-21-22-18-10-4-3-9-17(18)20(25)23(21)11-6-12-24/h3-5,7-10,24H,6,11-14H2,1-2H3