2-[[methyl-[(1-phenylpyrazol-4-yl)methyl]amino]methyl]-4-prop-2-enyl-1,2,4-triazole-3-thione

Systemtic Name: 2-[[methyl-[(1-phenylpyrazol-4-yl)methyl]amino]methyl]-4-prop-2-enyl-1,2,4-triazole-3-thione Openeye Name: 4-allyl-2-[[methyl-[(1-phenylpyrazol-4-yl)methyl]amino]methyl]-1,2,4-triazole-3-thione CAS Name: 2-[[methyl-[(1-phenyl-4-pyrazolyl)methyl]amino]methyl]-4-prop-2-enyl-1,2,4-triazole-3-thione IUPAC Name: 2-[[methyl-[(1-phenylpyrazol-4-yl)methyl]amino]methyl]-4-prop-2-enyl-1,2,4-triazole-3-thione Traditional Name: 4-allyl-2-[[methyl-[(1-phenylpyrazol-4-yl)methyl]amino]methyl]-1,2,4-triazole-3-thione Formula: C17H20N6S MolecularWeight: 340.4459

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CN(N=C1)C2=CC=CC=C2)CN3C(=S)N(C=N3)CC=C

Isomeric SMILES

CN(CC1=CN(N=C1)C2=CC=CC=C2)CN3C(=S)N(C=N3)CC=C

InChI

InChI=1S/C17H20N6S/c1-3-9-21-13-19-23(17(21)24)14-20(2)11-15-10-18-22(12-15)16-7-5-4-6-8-16/h3-8,10,12-13H,1,9,11,14H2,2H3