(1E)-1-[azanyl-(3,5-dimethylpyrazol-1-yl)methylidene]-3-(4-sulfamoylphenyl)thiourea

Systemtic Name: (1E)-1-[azanyl-(3,5-dimethylpyrazol-1-yl)methylidene]-3-(4-sulfamoylphenyl)thiourea Openeye Name: (1E)-1-[amino-(3,5-dimethylpyrazol-1-yl)methylene]-3-(4-sulfamoylphenyl)thiourea CAS Name: (1E)-1-[amino-(3,5-dimethyl-1-pyrazolyl)methylidene]-3-(4-sulfamoylphenyl)thiourea IUPAC Name: (1E)-1-[amino-(3,5-dimethylpyrazol-1-yl)methylidene]-3-(4-sulfamoylphenyl)thiourea Traditional Name: (1E)-1-[amino-(3,5-dimethylpyrazol-1-yl)methylene]-3-(4-sulfamoylphenyl)thiourea Formula: C13H16N6O2S2 MolecularWeight: 352.43514

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C(=NC(=S)NC2=CC=C(C=C2)S(=O)(=O)N)N)C

Isomeric SMILES

CC1=CC(=NN1/C(=N/C(=S)NC2=CC=C(C=C2)S(=O)(=O)N)/N)C

InChI

InChI=1S/C13H16N6O2S2/c1-8-7-9(2)19(18-8)12(14)17-13(22)16-10-3-5-11(6-4-10)23(15,20)21/h3-7H,1-2H3,(H2,15,20,21)(H3,14,16,17,22)