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

Systemtic Name: 2-[[4-ethyl-5-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]quinoline Openeye Name: 2-[[4-ethyl-5-(o-tolyl)-1,2,4-triazol-3-yl]sulfanylmethyl]quinoline CAS Name: 2-[[[4-ethyl-5-(2-methylphenyl)-1,2,4-triazol-3-yl]thio]methyl]quinoline IUPAC Name: 2-[[4-ethyl-5-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]quinoline Traditional Name: 2-[[[4-ethyl-5-(o-tolyl)-1,2,4-triazol-3-yl]thio]methyl]quinoline Formula: C21H20N4S MolecularWeight: 360.4753

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC2=NC3=CC=CC=C3C=C2)C4=CC=CC=C4C

Isomeric SMILES

CCN1C(=NN=C1SCC2=NC3=CC=CC=C3C=C2)C4=CC=CC=C4C

InChI

InChI=1S/C21H20N4S/c1-3-25-20(18-10-6-4-8-15(18)2)23-24-21(25)26-14-17-13-12-16-9-5-7-11-19(16)22-17/h4-13H,3,14H2,1-2H3