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

Systemtic Name: 2-[[(1,3-diphenylpyrazol-4-yl)methyl-methyl-amino]methyl]-4-methyl-1,2,4-triazole-3-thione Openeye Name: 2-[[(1,3-diphenylpyrazol-4-yl)methyl-methyl-amino]methyl]-4-methyl-1,2,4-triazole-3-thione CAS Name: 2-[[(1,3-diphenyl-4-pyrazolyl)methyl-methylamino]methyl]-4-methyl-1,2,4-triazole-3-thione IUPAC Name: 2-[[(1,3-diphenylpyrazol-4-yl)methyl-methylamino]methyl]-4-methyl-1,2,4-triazole-3-thione Traditional Name: 2-[[(1,3-diphenylpyrazol-4-yl)methyl-methyl-amino]methyl]-4-methyl-1,2,4-triazole-3-thione Formula: C21H22N6S MolecularWeight: 390.50458

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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

Isomeric SMILES

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

InChI

InChI=1S/C21H22N6S/c1-24(16-27-21(28)25(2)15-22-27)13-18-14-26(19-11-7-4-8-12-19)23-20(18)17-9-5-3-6-10-17/h3-12,14-15H,13,16H2,1-2H3