(4-cyclopropyl-3-ethyl-5-oxidanylidene-1,2,4-triazol-1-yl)carbonyl-[3-(dimethylcarbamoyl)pyridin-2-yl]-sulfonyl-azanium

Systemtic Name: (4-cyclopropyl-3-ethyl-5-oxidanylidene-1,2,4-triazol-1-yl)carbonyl-[3-(dimethylcarbamoyl)pyridin-2-yl]-sulfonyl-azanium Openeye Name: (4-cyclopropyl-3-ethyl-5-oxo-1,2,4-triazole-1-carbonyl)-[3-(dimethylcarbamoyl)-2-pyridyl]-sulfonyl-ammonium CAS Name: [(4-cyclopropyl-3-ethyl-5-oxo-1,2,4-triazol-1-yl)-oxomethyl]-[3-[dimethylamino(oxo)methyl]-2-pyridinyl]-sulfonylammonium IUPAC Name: (4-cyclopropyl-3-ethyl-5-oxo-1,2,4-triazole-1-carbonyl)-[3-(dimethylcarbamoyl)pyridin-2-yl]-sulfonylazanium Traditional Name: (4-cyclopropyl-3-ethyl-5-keto-1,2,4-triazole-1-carbonyl)-[3-(dimethylcarbamoyl)-2-pyridyl]-sulfonyl-ammonium Formula: C16H19N6O5S+ MolecularWeight: 407.42426

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C(=O)N1C2CC2)C(=O)[N+](=S(=O)=O)C3=C(C=CC=N3)C(=O)N(C)C

Isomeric SMILES

CCC1=NN(C(=O)N1C2CC2)C(=O)[N+](=S(=O)=O)C3=C(C=CC=N3)C(=O)N(C)C

InChI

InChI=1S/C16H19N6O5S/c1-4-12-18-21(15(24)20(12)10-7-8-10)16(25)22(28(26)27)13-11(6-5-9-17-13)14(23)19(2)3/h5-6,9-10H,4,7-8H2,1-3H3/q+1