4-[(5-ethyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanylmethyl]pyridine

Systemtic Name: 4-[(5-ethyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanylmethyl]pyridine Openeye Name: 4-[(4-allyl-5-ethyl-1,2,4-triazol-3-yl)sulfanylmethyl]pyridine CAS Name: 4-[[(5-ethyl-4-prop-2-enyl-1,2,4-triazol-3-yl)thio]methyl]pyridine IUPAC Name: 4-[(5-ethyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanylmethyl]pyridine Traditional Name: 4-[[(4-allyl-5-ethyl-1,2,4-triazol-3-yl)thio]methyl]pyridine Formula: C13H16N4S MolecularWeight: 260.35794

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=C(N1CC=C)SCC2=CC=NC=C2

Isomeric SMILES

CCC1=NN=C(N1CC=C)SCC2=CC=NC=C2

InChI

InChI=1S/C13H16N4S/c1-3-9-17-12(4-2)15-16-13(17)18-10-11-5-7-14-8-6-11/h3,5-8H,1,4,9-10H2,2H3