5-(4-ethylphenyl)-3-prop-2-enylsulfanyl-1H-1,2,4-triazole

Systemtic Name: 5-(4-ethylphenyl)-3-prop-2-enylsulfanyl-1H-1,2,4-triazole Openeye Name: 3-allylsulfanyl-5-(4-ethylphenyl)-1H-1,2,4-triazole CAS Name: 5-(4-ethylphenyl)-3-(prop-2-enylthio)-1H-1,2,4-triazole IUPAC Name: 5-(4-ethylphenyl)-3-prop-2-enylsulfanyl-1H-1,2,4-triazole Traditional Name: 3-(allylthio)-5-(4-ethylphenyl)-1H-1,2,4-triazole Formula: C13H15N3S MolecularWeight: 245.3433

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NC(=NN2)SCC=C

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NC(=NN2)SCC=C

InChI

InChI=1S/C13H15N3S/c1-3-9-17-13-14-12(15-16-13)11-7-5-10(4-2)6-8-11/h3,5-8H,1,4,9H2,2H3,(H,14,15,16)