5-ethyl-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-3-oxidanylidene-2-phenyl-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide

Systemtic Name: 5-ethyl-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-3-oxidanylidene-2-phenyl-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide Openeye Name: 5-ethyl-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-3-oxo-2-phenyl-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide CAS Name: 5-ethyl-N-[5-(ethylthio)-1,3,4-thiadiazol-2-yl]-3-oxo-2-phenyl-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide IUPAC Name: 5-ethyl-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-3-oxo-2-phenyl-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide Traditional Name: 5-ethyl-N-[5-(ethylthio)-1,3,4-thiadiazol-2-yl]-3-keto-2-phenyl-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide Formula: C19H19N6O2S2+ MolecularWeight: 427.52316

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=CC(=C2C(=C1)C(=O)N(N2)C3=CC=CC=C3)C(=O)NC4=NN=C(S4)SCC

Isomeric SMILES

CC[N+]1=CC(=C2C(=C1)C(=O)N(N2)C3=CC=CC=C3)C(=O)NC4=NN=C(S4)SCC

InChI

InChI=1S/C19H18N6O2S2/c1-3-24-10-13(16(26)20-18-21-22-19(29-18)28-4-2)15-14(11-24)17(27)25(23-15)12-8-6-5-7-9-12/h5-11H,3-4H2,1-2H3,(H,20,21,26)/p+1