N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-2-[(1-methyl-2H-1,2,3,4-tetrazol-1-ium-5-yl)sulfanyl]ethanamide

Systemtic Name: N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-2-[(1-methyl-2H-1,2,3,4-tetrazol-1-ium-5-yl)sulfanyl]ethanamide Openeye Name: N-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-2-[(1-methyl-2H-tetrazol-1-ium-5-yl)sulfanyl]acetamide CAS Name: N-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-2-[(1-methyl-2H-tetrazol-1-ium-5-yl)thio]acetamide IUPAC Name: N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-2-[(1-methyl-2H-tetrazol-1-ium-5-yl)sulfanyl]acetamide Traditional Name: N-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)-2-[(1-methyl-2H-tetrazol-1-ium-5-yl)thio]acetamide Formula: C15H18N7O2S+ MolecularWeight: 360.41412

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)CSC3=[N+](NN=N3)C

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)CSC3=[N+](NN=N3)C

InChI

InChI=1S/C15H17N7O2S/c1-10-13(16-12(23)9-25-15-17-18-19-20(15)2)14(24)22(21(10)3)11-7-5-4-6-8-11/h4-8H,9H2,1-3H3,(H,16,23)/p+1