3-butyl-4-[(E)-(phenylmethylidene)amino]-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-butyl-4-[(E)-(phenylmethylidene)amino]-1H-1,2,4-triazole-5-thione Openeye Name: 4-[(E)-benzylideneamino]-3-butyl-1H-1,2,4-triazole-5-thione CAS Name: 3-butyl-4-[(E)-(phenylmethylene)amino]-1H-1,2,4-triazole-5-thione IUPAC Name: 4-[(E)-benzylideneamino]-3-butyl-1H-1,2,4-triazole-5-thione Traditional Name: 4-[(E)-benzalamino]-3-butyl-1H-1,2,4-triazole-5-thione Formula: C13H16N4S MolecularWeight: 260.35794

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NNC(=S)N1N=CC2=CC=CC=C2

Isomeric SMILES

CCCCC1=NNC(=S)N1/N=C/C2=CC=CC=C2

InChI

InChI=1S/C13H16N4S/c1-2-3-9-12-15-16-13(18)17(12)14-10-11-7-5-4-6-8-11/h4-8,10H,2-3,9H2,1H3,(H,16,18)/b14-10+