3-[(2,5-dimethylphenyl)sulfanylmethyl]-1,2,3-benzotriazin-4-one

Systemtic Name: 3-[(2,5-dimethylphenyl)sulfanylmethyl]-1,2,3-benzotriazin-4-one Openeye Name: 3-[(2,5-dimethylphenyl)sulfanylmethyl]-1,2,3-benzotriazin-4-one CAS Name: 3-[[(2,5-dimethylphenyl)thio]methyl]-1,2,3-benzotriazin-4-one IUPAC Name: 3-[(2,5-dimethylphenyl)sulfanylmethyl]-1,2,3-benzotriazin-4-one Traditional Name: 3-[[(2,5-dimethylphenyl)thio]methyl]-1,2,3-benzotriazin-4-one Formula: C16H15N3OS MolecularWeight: 297.3748

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)SCN2C(=O)C3=CC=CC=C3N=N2

Isomeric SMILES

CC1=CC(=C(C=C1)C)SCN2C(=O)C3=CC=CC=C3N=N2

InChI

InChI=1S/C16H15N3OS/c1-11-7-8-12(2)15(9-11)21-10-19-16(20)13-5-3-4-6-14(13)17-18-19/h3-9H,10H2,1-2H3