2-(4-azanylpiperidin-1-yl)-N-[bis(azanyl)methylidene]-5-methylsulfonyl-benzamide dihydrochloride

Systemtic Name: 2-(4-azanylpiperidin-1-yl)-N-[bis(azanyl)methylidene]-5-methylsulfonyl-benzamide dihydrochloride Openeye Name: 2-(4-amino-1-piperidyl)-N-(diaminomethylene)-5-methylsulfonyl-benzamide dihydrochloride CAS Name: 2-(4-amino-1-piperidinyl)-N-(diaminomethylidene)-5-methylsulfonylbenzamide dihydrochloride IUPAC Name: 2-(4-aminopiperidin-1-yl)-N-(diaminomethylidene)-5-methylsulfonylbenzamide dihydrochloride Traditional Name: 2-(4-aminopiperidino)-N-(diaminomethylene)-5-mesyl-benzamide dihydrochloride Formula: C14H23Cl2N5O3S MolecularWeight: 412.33512

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)N2CCC(CC2)N)C(=O)N=C(N)N.Cl.Cl

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)N2CCC(CC2)N)C(=O)N=C(N)N.Cl.Cl

InChI

InChI=1S/C14H21N5O3S.2ClH/c1-23(21,22)10-2-3-12(19-6-4-9(15)5-7-19)11(8-10)13(20)18-14(16)17;;/h2-3,8-9H,4-7,15H2,1H3,(H4,16,17,18,20);2*1H