2-[[[1,1-bis(oxidanylidene)thiolan-3-yl]-methyl-amino]methyl]-5-phenyl-1H-1,2,4-triazole-3-thione

Systemtic Name: 2-[[[1,1-bis(oxidanylidene)thiolan-3-yl]-methyl-amino]methyl]-5-phenyl-1H-1,2,4-triazole-3-thione Openeye Name: 2-[[(1,1-dioxothiolan-3-yl)-methyl-amino]methyl]-5-phenyl-1H-1,2,4-triazole-3-thione CAS Name: 2-[[(1,1-dioxo-3-thiolanyl)-methylamino]methyl]-5-phenyl-1H-1,2,4-triazole-3-thione IUPAC Name: 2-[[(1,1-dioxothiolan-3-yl)-methylamino]methyl]-5-phenyl-1H-1,2,4-triazole-3-thione Traditional Name: 2-[[(1,1-diketothiolan-3-yl)-methyl-amino]methyl]-5-phenyl-1H-1,2,4-triazole-3-thione Formula: C14H18N4O2S2 MolecularWeight: 338.44832

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Descriptors Computed from Structure

Canonical SMILES:

CN(CN1C(=S)N=C(N1)C2=CC=CC=C2)C3CCS(=O)(=O)C3

Isomeric SMILES

CN(CN1C(=S)N=C(N1)C2=CC=CC=C2)C3CCS(=O)(=O)C3

InChI

InChI=1S/C14H18N4O2S2/c1-17(12-7-8-22(19,20)9-12)10-18-14(21)15-13(16-18)11-5-3-2-4-6-11/h2-6,12H,7-10H2,1H3,(H,15,16,21)