3-azanyl-4-[(4-butoxyphenyl)methyl]-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-azanyl-4-[(4-butoxyphenyl)methyl]-1H-1,2,4-triazole-5-thione Openeye Name: 3-amino-4-[(4-butoxyphenyl)methyl]-1H-1,2,4-triazole-5-thione CAS Name: 3-amino-4-[(4-butoxyphenyl)methyl]-1H-1,2,4-triazole-5-thione IUPAC Name: 3-amino-4-[(4-butoxyphenyl)methyl]-1H-1,2,4-triazole-5-thione Traditional Name: 3-amino-4-(4-butoxybenzyl)-1H-1,2,4-triazole-5-thione Formula: C13H18N4OS MolecularWeight: 278.37322

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)CN2C(=NNC2=S)N

Isomeric SMILES

CCCCOC1=CC=C(C=C1)CN2C(=NNC2=S)N

InChI

InChI=1S/C13H18N4OS/c1-2-3-8-18-11-6-4-10(5-7-11)9-17-12(14)15-16-13(17)19/h4-7H,2-3,8-9H2,1H3,(H2,14,15)(H,16,19)