4-azanyl-N-[(Z)-N'-chloranylcarbamimidoyl]-3-methylsulfonyl-benzamide dihydrochloride

Systemtic Name: 4-azanyl-N-[(Z)-N'-chloranylcarbamimidoyl]-3-methylsulfonyl-benzamide dihydrochloride Openeye Name: 4-amino-N-[(Z)-N'-chlorocarbamimidoyl]-3-methylsulfonyl-benzamide dihydrochloride CAS Name: 4-amino-N-[(Z)-amino(chloroimino)methyl]-3-methylsulfonylbenzamide dihydrochloride IUPAC Name: 4-amino-N-[(Z)-N'-chlorocarbamimidoyl]-3-methylsulfonylbenzamide dihydrochloride Traditional Name: 4-amino-N-[(Z)-N'-chloroamidino]-3-mesyl-benzamide dihydrochloride Formula: C9H13Cl3N4O3S MolecularWeight: 363.64852

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C=CC(=C1)C(=O)NC(=NCl)N)N.Cl.Cl

Isomeric SMILES

CS(=O)(=O)C1=C(C=CC(=C1)C(=O)N/C(=N\Cl)/N)N.Cl.Cl

InChI

InChI=1S/C9H11ClN4O3S.2ClH/c1-18(16,17)7-4-5(2-3-6(7)11)8(15)13-9(12)14-10;;/h2-4H,11H2,1H3,(H3,12,13,14,15);2*1H