(4E)-4-[[4-[bis(azanyl)methylideneamino]sulfonylphenyl]hydrazinylidene]-3-methyl-5-oxidanylidene-pyrazole-1-carboxamide

Systemtic Name: (4E)-4-[[4-[bis(azanyl)methylideneamino]sulfonylphenyl]hydrazinylidene]-3-methyl-5-oxidanylidene-pyrazole-1-carboxamide Openeye Name: (4E)-4-[(4-guanidinosulfonylphenyl)hydrazono]-3-methyl-5-oxo-pyrazole-1-carboxamide CAS Name: (4E)-4-[[4-(diaminomethylideneamino)sulfonylphenyl]hydrazinylidene]-3-methyl-5-oxo-1-pyrazolecarboxamide IUPAC Name: (4E)-4-[[4-(diaminomethylideneamino)sulfonylphenyl]hydrazinylidene]-3-methyl-5-oxopyrazole-1-carboxamide Traditional Name: (4E)-4-[(4-guanidinosulfonylphenyl)hydrazono]-5-keto-3-methyl-2-pyrazoline-1-carboxamide Formula: C12H14N8O4S MolecularWeight: 366.35576

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=NNC2=CC=C(C=C2)S(=O)(=O)N=C(N)N)C(=O)N

Isomeric SMILES

CC\1=NN(C(=O)/C1=N/NC2=CC=C(C=C2)S(=O)(=O)N=C(N)N)C(=O)N

InChI

InChI=1S/C12H14N8O4S/c1-6-9(10(21)20(18-6)12(15)22)17-16-7-2-4-8(5-3-7)25(23,24)19-11(13)14/h2-5,16H,1H3,(H2,15,22)(H4,13,14,19)/b17-9+