N-[bis(azanyl)methylidene]-3-pyrrol-1-yl-5-sulfamoyl-benzamide; methanesulfonate

Systemtic Name: N-[bis(azanyl)methylidene]-3-pyrrol-1-yl-5-sulfamoyl-benzamide; methanesulfonate Openeye Name: N-(diaminomethylene)-3-pyrrol-1-yl-5-sulfamoyl-benzamide; methanesulfonate CAS Name: N-(diaminomethylidene)-3-(1-pyrrolyl)-5-sulfamoylbenzamide; methanesulfonate IUPAC Name: N-(diaminomethylidene)-3-pyrrol-1-yl-5-sulfamoylbenzamide; methanesulfonate Traditional Name: N-(diaminomethylene)-3-pyrrol-1-yl-5-sulfamoyl-benzamide mesylate Formula: C13H16N5O6S2- MolecularWeight: 402.42604

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)[O-].C1=CN(C=C1)C2=CC(=CC(=C2)C(=O)N=C(N)N)S(=O)(=O)N

Isomeric SMILES

CS(=O)(=O)[O-].C1=CN(C=C1)C2=CC(=CC(=C2)C(=O)N=C(N)N)S(=O)(=O)N

InChI

InChI=1S/C12H13N5O3S.CH4O3S/c13-12(14)16-11(18)8-5-9(17-3-1-2-4-17)7-10(6-8)21(15,19)20;1-5(2,3)4/h1-7H,(H2,15,19,20)(H4,13,14,16,18);1H3,(H,2,3,4)/p-1