3-[(3-methylpyrazol-1-yl)methyl]-4-(phenylmethyl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-[(3-methylpyrazol-1-yl)methyl]-4-(phenylmethyl)-1H-1,2,4-triazole-5-thione Openeye Name: 4-benzyl-3-[(3-methylpyrazol-1-yl)methyl]-1H-1,2,4-triazole-5-thione CAS Name: 3-[(3-methyl-1-pyrazolyl)methyl]-4-(phenylmethyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 4-benzyl-3-[(3-methylpyrazol-1-yl)methyl]-1H-1,2,4-triazole-5-thione Traditional Name: 4-benzyl-3-[(3-methylpyrazol-1-yl)methyl]-1H-1,2,4-triazole-5-thione Formula: C14H15N5S MolecularWeight: 285.3674

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1)CC2=NNC(=S)N2CC3=CC=CC=C3

Isomeric SMILES

CC1=NN(C=C1)CC2=NNC(=S)N2CC3=CC=CC=C3

InChI

InChI=1S/C14H15N5S/c1-11-7-8-18(17-11)10-13-15-16-14(20)19(13)9-12-5-3-2-4-6-12/h2-8H,9-10H2,1H3,(H,16,20)