3-[(5-cyclopropyl-4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]benzenecarbonitrile

Systemtic Name: 3-[(5-cyclopropyl-4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]benzenecarbonitrile Openeye Name: 3-[(5-cyclopropyl-4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]benzonitrile CAS Name: 3-[[(5-cyclopropyl-4-methyl-1,2,4-triazol-3-yl)thio]methyl]benzonitrile IUPAC Name: 3-[(5-cyclopropyl-4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]benzonitrile Traditional Name: 3-[[(5-cyclopropyl-4-methyl-1,2,4-triazol-3-yl)thio]methyl]benzonitrile Formula: C14H14N4S MolecularWeight: 270.35276

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC2=CC=CC(=C2)C#N)C3CC3

Isomeric SMILES

CN1C(=NN=C1SCC2=CC=CC(=C2)C#N)C3CC3

InChI

InChI=1S/C14H14N4S/c1-18-13(12-5-6-12)16-17-14(18)19-9-11-4-2-3-10(7-11)8-15/h2-4,7,12H,5-6,9H2,1H3