dimethyl-[[[3-(3-nitropyridin-2-yl)sulfanyl-1H-1,2,4-triazol-5-yl]amino]methylidene]azanium

Systemtic Name: dimethyl-[[[3-(3-nitropyridin-2-yl)sulfanyl-1H-1,2,4-triazol-5-yl]amino]methylidene]azanium Openeye Name: dimethyl-[[[3-[(3-nitro-2-pyridyl)sulfanyl]-1H-1,2,4-triazol-5-yl]amino]methylene]ammonium CAS Name: dimethyl-[[[3-[(3-nitro-2-pyridinyl)thio]-1H-1,2,4-triazol-5-yl]amino]methylidene]ammonium IUPAC Name: dimethyl-[[[3-(3-nitropyridin-2-yl)sulfanyl-1H-1,2,4-triazol-5-yl]amino]methylidene]azanium Traditional Name: dimethyl-[[[3-[(3-nitro-2-pyridyl)thio]-1H-1,2,4-triazol-5-yl]amino]methylene]ammonium Formula: C10H12N7O2S+ MolecularWeight: 294.31298

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](=CNC1=NC(=NN1)SC2=C(C=CC=N2)[N+](=O)[O-])C

Isomeric SMILES

C[N+](=CNC1=NC(=NN1)SC2=C(C=CC=N2)[N+](=O)[O-])C

InChI

InChI=1S/C10H11N7O2S/c1-16(2)6-12-9-13-10(15-14-9)20-8-7(17(18)19)4-3-5-11-8/h3-6H,1-2H3,(H,13,14,15)/p+1