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

Systemtic Name: 4-[(3-methylphenyl)methylamino]-3-propyl-1H-1,2,4-triazole-5-thione Openeye Name: 4-(m-tolylmethylamino)-3-propyl-1H-1,2,4-triazole-5-thione CAS Name: 4-[(3-methylphenyl)methylamino]-3-propyl-1H-1,2,4-triazole-5-thione IUPAC Name: 4-[(3-methylphenyl)methylamino]-3-propyl-1H-1,2,4-triazole-5-thione Traditional Name: 4-[(3-methylbenzyl)amino]-3-propyl-1H-1,2,4-triazole-5-thione Formula: C13H18N4S MolecularWeight: 262.37382

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NNC(=S)N1NCC2=CC=CC(=C2)C

Isomeric SMILES

CCCC1=NNC(=S)N1NCC2=CC=CC(=C2)C

InChI

InChI=1S/C13H18N4S/c1-3-5-12-15-16-13(18)17(12)14-9-11-7-4-6-10(2)8-11/h4,6-8,14H,3,5,9H2,1-2H3,(H,16,18)