1-[(4-methylphenyl)sulfanylmethyl]benzotriazole

Systemtic Name: 1-[(4-methylphenyl)sulfanylmethyl]benzotriazole Openeye Name: 1-(p-tolylsulfanylmethyl)benzotriazole CAS Name: 1-[[(4-methylphenyl)thio]methyl]benzotriazole IUPAC Name: 1-[(4-methylphenyl)sulfanylmethyl]benzotriazole Traditional Name: 1-[(p-tolylthio)methyl]benzotriazole Formula: C14H13N3S MolecularWeight: 255.33812

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCN2C3=CC=CC=C3N=N2

Isomeric SMILES

CC1=CC=C(C=C1)SCN2C3=CC=CC=C3N=N2

InChI

InChI=1S/C14H13N3S/c1-11-6-8-12(9-7-11)18-10-17-14-5-3-2-4-13(14)15-16-17/h2-9H,10H2,1H3