3-(3-methylphenyl)-2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)methylsulfanyl]quinazolin-4-one

Systemtic Name: 3-(3-methylphenyl)-2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)methylsulfanyl]quinazolin-4-one Openeye Name: 3-(m-tolyl)-2-[(1-phenyltetrazol-5-yl)methylsulfanyl]quinazolin-4-one CAS Name: 3-(3-methylphenyl)-2-[(1-phenyl-5-tetrazolyl)methylthio]-4-quinazolinone IUPAC Name: 3-(3-methylphenyl)-2-[(1-phenyltetrazol-5-yl)methylsulfanyl]quinazolin-4-one Traditional Name: 3-(m-tolyl)-2-[(1-phenyltetrazol-5-yl)methylthio]quinazolin-4-one Formula: C23H18N6OS MolecularWeight: 426.49362

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=O)C3=CC=CC=C3N=C2SCC4=NN=NN4C5=CC=CC=C5

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=O)C3=CC=CC=C3N=C2SCC4=NN=NN4C5=CC=CC=C5

InChI

InChI=1S/C23H18N6OS/c1-16-8-7-11-18(14-16)28-22(30)19-12-5-6-13-20(19)24-23(28)31-15-21-25-26-27-29(21)17-9-3-2-4-10-17/h2-14H,15H2,1H3