4-(4-azanylpiperidin-1-yl)-N-[bis(azanyl)methylidene]-3-sulfamoyl-benzamide dihydrochloride

Systemtic Name: 4-(4-azanylpiperidin-1-yl)-N-[bis(azanyl)methylidene]-3-sulfamoyl-benzamide dihydrochloride Openeye Name: 4-(4-amino-1-piperidyl)-N-(diaminomethylene)-3-sulfamoyl-benzamide dihydrochloride CAS Name: 4-(4-amino-1-piperidinyl)-N-(diaminomethylidene)-3-sulfamoylbenzamide dihydrochloride IUPAC Name: 4-(4-aminopiperidin-1-yl)-N-(diaminomethylidene)-3-sulfamoylbenzamide dihydrochloride Traditional Name: 4-(4-aminopiperidino)-N-(diaminomethylene)-3-sulfamoyl-benzamide dihydrochloride Formula: C13H22Cl2N6O3S MolecularWeight: 413.32318

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N)C2=C(C=C(C=C2)C(=O)N=C(N)N)S(=O)(=O)N.Cl.Cl

Isomeric SMILES

C1CN(CCC1N)C2=C(C=C(C=C2)C(=O)N=C(N)N)S(=O)(=O)N.Cl.Cl

InChI

InChI=1S/C13H20N6O3S.2ClH/c14-9-3-5-19(6-4-9)10-2-1-8(12(20)18-13(15)16)7-11(10)23(17,21)22;;/h1-2,7,9H,3-6,14H2,(H2,17,21,22)(H4,15,16,18,20);2*1H