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

Systemtic Name: 2-[[methyl-[(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)methyl]amino]methyl]-4-prop-2-enyl-1,2,4-triazole-3-thione Openeye Name: 4-allyl-2-[[methyl-[[1-phenyl-3-(2-thienyl)pyrazol-4-yl]methyl]amino]methyl]-1,2,4-triazole-3-thione CAS Name: 2-[[methyl-[(1-phenyl-3-thiophen-2-yl-4-pyrazolyl)methyl]amino]methyl]-4-prop-2-enyl-1,2,4-triazole-3-thione IUPAC Name: 2-[[methyl-[(1-phenyl-3-thiophen-2-ylpyrazol-4-yl)methyl]amino]methyl]-4-prop-2-enyl-1,2,4-triazole-3-thione Traditional Name: 4-allyl-2-[[methyl-[[1-phenyl-3-(2-thienyl)pyrazol-4-yl]methyl]amino]methyl]-1,2,4-triazole-3-thione Formula: C21H22N6S2 MolecularWeight: 422.56958

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CN(N=C1C2=CC=CS2)C3=CC=CC=C3)CN4C(=S)N(C=N4)CC=C

Isomeric SMILES

CN(CC1=CN(N=C1C2=CC=CS2)C3=CC=CC=C3)CN4C(=S)N(C=N4)CC=C

InChI

InChI=1S/C21H22N6S2/c1-3-11-25-15-22-27(21(25)28)16-24(2)13-17-14-26(18-8-5-4-6-9-18)23-20(17)19-10-7-12-29-19/h3-10,12,14-15H,1,11,13,16H2,2H3