3-[[7-chloranyl-3-(3-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylmethyl]-1,2,3-benzotriazin-4-one

Systemtic Name: 3-[[7-chloranyl-3-(3-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylmethyl]-1,2,3-benzotriazin-4-one Openeye Name: 3-[[7-chloro-3-(m-tolyl)-4-oxo-quinazolin-2-yl]sulfanylmethyl]-1,2,3-benzotriazin-4-one CAS Name: 3-[[[7-chloro-3-(3-methylphenyl)-4-oxo-2-quinazolinyl]thio]methyl]-1,2,3-benzotriazin-4-one IUPAC Name: 3-[[7-chloro-3-(3-methylphenyl)-4-oxoquinazolin-2-yl]sulfanylmethyl]-1,2,3-benzotriazin-4-one Traditional Name: 3-[[[7-chloro-4-keto-3-(m-tolyl)quinazolin-2-yl]thio]methyl]-1,2,3-benzotriazin-4-one Formula: C23H16ClN5O2S MolecularWeight: 461.92344

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=O)C3=C(C=C(C=C3)Cl)N=C2SCN4C(=O)C5=CC=CC=C5N=N4

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=O)C3=C(C=C(C=C3)Cl)N=C2SCN4C(=O)C5=CC=CC=C5N=N4

InChI

InChI=1S/C23H16ClN5O2S/c1-14-5-4-6-16(11-14)29-22(31)18-10-9-15(24)12-20(18)25-23(29)32-13-28-21(30)17-7-2-3-8-19(17)26-27-28/h2-12H,13H2,1H3