4-(4-butylphenyl)-3-(methoxymethyl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-(4-butylphenyl)-3-(methoxymethyl)-1H-1,2,4-triazole-5-thione Openeye Name: 4-(4-butylphenyl)-3-(methoxymethyl)-1H-1,2,4-triazole-5-thione CAS Name: 4-(4-butylphenyl)-3-(methoxymethyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 4-(4-butylphenyl)-3-(methoxymethyl)-1H-1,2,4-triazole-5-thione Traditional Name: 4-(4-butylphenyl)-3-(methoxymethyl)-1H-1,2,4-triazole-5-thione Formula: C14H19N3OS MolecularWeight: 277.38516

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)N2C(=NNC2=S)COC

Isomeric SMILES

CCCCC1=CC=C(C=C1)N2C(=NNC2=S)COC

InChI

InChI=1S/C14H19N3OS/c1-3-4-5-11-6-8-12(9-7-11)17-13(10-18-2)15-16-14(17)19/h6-9H,3-5,10H2,1-2H3,(H,16,19)