3-(4-ethylphenyl)-2-[(3-phenoxyphenyl)methylsulfanyl]quinazolin-4-one

Systemtic Name: 3-(4-ethylphenyl)-2-[(3-phenoxyphenyl)methylsulfanyl]quinazolin-4-one Openeye Name: 3-(4-ethylphenyl)-2-[(3-phenoxyphenyl)methylsulfanyl]quinazolin-4-one CAS Name: 3-(4-ethylphenyl)-2-[(3-phenoxyphenyl)methylthio]-4-quinazolinone IUPAC Name: 3-(4-ethylphenyl)-2-[(3-phenoxyphenyl)methylsulfanyl]quinazolin-4-one Traditional Name: 3-(4-ethylphenyl)-2-[(3-phenoxybenzyl)thio]quinazolin-4-one Formula: C29H24N2O2S MolecularWeight: 464.57806

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC4=CC(=CC=C4)OC5=CC=CC=C5

Isomeric SMILES

CCC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC4=CC(=CC=C4)OC5=CC=CC=C5

InChI

InChI=1S/C29H24N2O2S/c1-2-21-15-17-23(18-16-21)31-28(32)26-13-6-7-14-27(26)30-29(31)34-20-22-9-8-12-25(19-22)33-24-10-4-3-5-11-24/h3-19H,2,20H2,1H3