4-[(4-methylphenyl)methyl]-3-propyl-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-[(4-methylphenyl)methyl]-3-propyl-1H-1,2,4-triazole-5-thione Openeye Name: 3-propyl-4-(p-tolylmethyl)-1H-1,2,4-triazole-5-thione CAS Name: 4-[(4-methylphenyl)methyl]-3-propyl-1H-1,2,4-triazole-5-thione IUPAC Name: 4-[(4-methylphenyl)methyl]-3-propyl-1H-1,2,4-triazole-5-thione Traditional Name: 4-(4-methylbenzyl)-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)N1CC2=CC=C(C=C2)C

Isomeric SMILES

CCCC1=NNC(=S)N1CC2=CC=C(C=C2)C

InChI

InChI=1S/C13H17N3S/c1-3-4-12-14-15-13(17)16(12)9-11-7-5-10(2)6-8-11/h5-8H,3-4,9H2,1-2H3,(H,15,17)