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

Systemtic Name: 3-(methoxymethyl)-4-[1-[(4-methylphenyl)methyl]pyrazol-4-yl]-1H-1,2,4-triazole-5-thione Openeye Name: 3-(methoxymethyl)-4-[1-(p-tolylmethyl)pyrazol-4-yl]-1H-1,2,4-triazole-5-thione CAS Name: 3-(methoxymethyl)-4-[1-[(4-methylphenyl)methyl]-4-pyrazolyl]-1H-1,2,4-triazole-5-thione IUPAC Name: 3-(methoxymethyl)-4-[1-[(4-methylphenyl)methyl]pyrazol-4-yl]-1H-1,2,4-triazole-5-thione Traditional Name: 3-(methoxymethyl)-4-[1-(4-methylbenzyl)pyrazol-4-yl]-1H-1,2,4-triazole-5-thione Formula: C15H17N5OS MolecularWeight: 315.39338

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C=C(C=N2)N3C(=NNC3=S)COC

Isomeric SMILES

CC1=CC=C(C=C1)CN2C=C(C=N2)N3C(=NNC3=S)COC

InChI

InChI=1S/C15H17N5OS/c1-11-3-5-12(6-4-11)8-19-9-13(7-16-19)20-14(10-21-2)17-18-15(20)22/h3-7,9H,8,10H2,1-2H3,(H,18,22)