4-(4-ethylphenyl)-3-propyl-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-(4-ethylphenyl)-3-propyl-1H-1,2,4-triazole-5-thione Openeye Name: 4-(4-ethylphenyl)-3-propyl-1H-1,2,4-triazole-5-thione CAS Name: 4-(4-ethylphenyl)-3-propyl-1H-1,2,4-triazole-5-thione IUPAC Name: 4-(4-ethylphenyl)-3-propyl-1H-1,2,4-triazole-5-thione Traditional Name: 4-(4-ethylphenyl)-3-propyl-1H-1,2,4-triazole-5-thione Formula: C13H17N3S MolecularWeight: 247.35918

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NNC(=S)N1C2=CC=C(C=C2)CC

Isomeric SMILES

CCCC1=NNC(=S)N1C2=CC=C(C=C2)CC

InChI

InChI=1S/C13H17N3S/c1-3-5-12-14-15-13(17)16(12)11-8-6-10(4-2)7-9-11/h6-9H,3-5H2,1-2H3,(H,15,17)