6-[[4-ethyl-5-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]pyridine-3-carbonitrile

Systemtic Name: 6-[[4-ethyl-5-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]pyridine-3-carbonitrile Openeye Name: 6-[[4-ethyl-5-(o-tolyl)-1,2,4-triazol-3-yl]sulfanyl]pyridine-3-carbonitrile CAS Name: 6-[[4-ethyl-5-(2-methylphenyl)-1,2,4-triazol-3-yl]thio]-3-pyridinecarbonitrile IUPAC Name: 6-[[4-ethyl-5-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]pyridine-3-carbonitrile Traditional Name: 6-[[4-ethyl-5-(o-tolyl)-1,2,4-triazol-3-yl]thio]nicotinonitrile Formula: C17H15N5S MolecularWeight: 321.3995

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SC2=NC=C(C=C2)C#N)C3=CC=CC=C3C

Isomeric SMILES

CCN1C(=NN=C1SC2=NC=C(C=C2)C#N)C3=CC=CC=C3C

InChI

InChI=1S/C17H15N5S/c1-3-22-16(14-7-5-4-6-12(14)2)20-21-17(22)23-15-9-8-13(10-18)11-19-15/h4-9,11H,3H2,1-2H3