3-[4-ethyl-5-[(E)-3-phenylprop-2-enyl]sulfanyl-1,2,4-triazol-3-yl]pyridine

Systemtic Name: 3-[4-ethyl-5-[(E)-3-phenylprop-2-enyl]sulfanyl-1,2,4-triazol-3-yl]pyridine Openeye Name: 3-[5-[(E)-cinnamyl]sulfanyl-4-ethyl-1,2,4-triazol-3-yl]pyridine CAS Name: 3-[4-ethyl-5-[[(E)-3-phenylprop-2-enyl]thio]-1,2,4-triazol-3-yl]pyridine IUPAC Name: 3-[4-ethyl-5-[(E)-3-phenylprop-2-enyl]sulfanyl-1,2,4-triazol-3-yl]pyridine Traditional Name: 3-[5-[[(E)-cinnamyl]thio]-4-ethyl-1,2,4-triazol-3-yl]pyridine Formula: C18H18N4S MolecularWeight: 322.42732

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC=CC2=CC=CC=C2)C3=CN=CC=C3

Isomeric SMILES

CCN1C(=NN=C1SC/C=C/C2=CC=CC=C2)C3=CN=CC=C3

InChI

InChI=1S/C18H18N4S/c1-2-22-17(16-11-6-12-19-14-16)20-21-18(22)23-13-7-10-15-8-4-3-5-9-15/h3-12,14H,2,13H2,1H3/b10-7+