N,N-diethyl-3-[4-[(Z)-pyridin-3-ylmethylideneamino]-5-sulfanylidene-1H-1,2,4-triazol-3-yl]benzenesulfonamide

Systemtic Name: N,N-diethyl-3-[4-[(Z)-pyridin-3-ylmethylideneamino]-5-sulfanylidene-1H-1,2,4-triazol-3-yl]benzenesulfonamide Openeye Name: N,N-diethyl-3-[4-[(Z)-3-pyridylmethyleneamino]-5-thioxo-1H-1,2,4-triazol-3-yl]benzenesulfonamide CAS Name: N,N-diethyl-3-[4-[(Z)-3-pyridinylmethylideneamino]-5-sulfanylidene-1H-1,2,4-triazol-3-yl]benzenesulfonamide IUPAC Name: N,N-diethyl-3-[4-[(Z)-pyridin-3-ylmethylideneamino]-5-sulfanylidene-1H-1,2,4-triazol-3-yl]benzenesulfonamide Traditional Name: N,N-diethyl-3-[4-[(Z)-3-pyridylmethyleneamino]-5-thioxo-1H-1,2,4-triazol-3-yl]benzenesulfonamide Formula: C18H20N6O2S2 MolecularWeight: 416.5204

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)C2=NNC(=S)N2N=CC3=CN=CC=C3

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)C2=NNC(=S)N2/N=C\C3=CN=CC=C3

InChI

InChI=1S/C18H20N6O2S2/c1-3-23(4-2)28(25,26)16-9-5-8-15(11-16)17-21-22-18(27)24(17)20-13-14-7-6-10-19-12-14/h5-13H,3-4H2,1-2H3,(H,22,27)/b20-13-