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

Systemtic Name: 2-[4-ethyl-5-[(E)-3-phenylprop-2-enyl]sulfanyl-1,2,4-triazol-3-yl]pyrazine Openeye Name: 2-[5-[(E)-cinnamyl]sulfanyl-4-ethyl-1,2,4-triazol-3-yl]pyrazine CAS Name: 2-[4-ethyl-5-[[(E)-3-phenylprop-2-enyl]thio]-1,2,4-triazol-3-yl]pyrazine IUPAC Name: 2-[4-ethyl-5-[(E)-3-phenylprop-2-enyl]sulfanyl-1,2,4-triazol-3-yl]pyrazine Traditional Name: 2-[5-[[(E)-cinnamyl]thio]-4-ethyl-1,2,4-triazol-3-yl]pyrazine Formula: C17H17N5S MolecularWeight: 323.41538

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17N5S/c1-2-22-16(15-13-18-10-11-19-15)20-21-17(22)23-12-6-9-14-7-4-3-5-8-14/h3-11,13H,2,12H2,1H3/b9-6+