2-[[(1,3-diphenylpyrazol-4-yl)methyl-methyl-amino]methyl]-4-methyl-5-pyridin-3-yl-1,2,4-triazole-3-thione

Systemtic Name: 2-[[(1,3-diphenylpyrazol-4-yl)methyl-methyl-amino]methyl]-4-methyl-5-pyridin-3-yl-1,2,4-triazole-3-thione Openeye Name: 2-[[(1,3-diphenylpyrazol-4-yl)methyl-methyl-amino]methyl]-4-methyl-5-(3-pyridyl)-1,2,4-triazole-3-thione CAS Name: 2-[[(1,3-diphenyl-4-pyrazolyl)methyl-methylamino]methyl]-4-methyl-5-(3-pyridinyl)-1,2,4-triazole-3-thione IUPAC Name: 2-[[(1,3-diphenylpyrazol-4-yl)methyl-methylamino]methyl]-4-methyl-5-pyridin-3-yl-1,2,4-triazole-3-thione Traditional Name: 2-[[(1,3-diphenylpyrazol-4-yl)methyl-methyl-amino]methyl]-4-methyl-5-(3-pyridyl)-1,2,4-triazole-3-thione Formula: C26H25N7S MolecularWeight: 467.5886

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN(C1=S)CN(C)CC2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4)C5=CN=CC=C5

Isomeric SMILES

CN1C(=NN(C1=S)CN(C)CC2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4)C5=CN=CC=C5

InChI

InChI=1S/C26H25N7S/c1-30(19-33-26(34)31(2)25(29-33)21-12-9-15-27-16-21)17-22-18-32(23-13-7-4-8-14-23)28-24(22)20-10-5-3-6-11-20/h3-16,18H,17,19H2,1-2H3