3-[[4-ethyl-5-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]benzenecarbonitrile

Systemtic Name: 3-[[4-ethyl-5-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]benzenecarbonitrile Openeye Name: 3-[[4-ethyl-5-(o-tolyl)-1,2,4-triazol-3-yl]sulfanylmethyl]benzonitrile CAS Name: 3-[[[4-ethyl-5-(2-methylphenyl)-1,2,4-triazol-3-yl]thio]methyl]benzonitrile IUPAC Name: 3-[[4-ethyl-5-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]benzonitrile Traditional Name: 3-[[[4-ethyl-5-(o-tolyl)-1,2,4-triazol-3-yl]thio]methyl]benzonitrile Formula: C19H18N4S MolecularWeight: 334.43802

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC2=CC=CC(=C2)C#N)C3=CC=CC=C3C

Isomeric SMILES

CCN1C(=NN=C1SCC2=CC=CC(=C2)C#N)C3=CC=CC=C3C

InChI

InChI=1S/C19H18N4S/c1-3-23-18(17-10-5-4-7-14(17)2)21-22-19(23)24-13-16-9-6-8-15(11-16)12-20/h4-11H,3,13H2,1-2H3