3-(3,5-dimethylphenyl)-2-[2-(4-ethoxyphenoxy)ethylsulfanyl]quinazolin-4-one

Systemtic Name: 3-(3,5-dimethylphenyl)-2-[2-(4-ethoxyphenoxy)ethylsulfanyl]quinazolin-4-one Openeye Name: 3-(3,5-dimethylphenyl)-2-[2-(4-ethoxyphenoxy)ethylsulfanyl]quinazolin-4-one CAS Name: 3-(3,5-dimethylphenyl)-2-[2-(4-ethoxyphenoxy)ethylthio]-4-quinazolinone IUPAC Name: 3-(3,5-dimethylphenyl)-2-[2-(4-ethoxyphenoxy)ethylsulfanyl]quinazolin-4-one Traditional Name: 3-(3,5-dimethylphenyl)-2-[2-(4-ethoxyphenoxy)ethylthio]quinazolin-4-one Formula: C26H26N2O3S MolecularWeight: 446.56124

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)OCCSC2=NC3=CC=CC=C3C(=O)N2C4=CC(=CC(=C4)C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)OCCSC2=NC3=CC=CC=C3C(=O)N2C4=CC(=CC(=C4)C)C

InChI

InChI=1S/C26H26N2O3S/c1-4-30-21-9-11-22(12-10-21)31-13-14-32-26-27-24-8-6-5-7-23(24)25(29)28(26)20-16-18(2)15-19(3)17-20/h5-12,15-17H,4,13-14H2,1-3H3