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

Systemtic Name: N-[bis(azanyl)methylidene]-4-imidazol-1-yl-2-methyl-5-methylsulfonyl-benzamide dihydrochloride Openeye Name: N-(diaminomethylene)-4-imidazol-1-yl-2-methyl-5-methylsulfonyl-benzamide dihydrochloride CAS Name: N-(diaminomethylidene)-4-(1-imidazolyl)-2-methyl-5-methylsulfonylbenzamide dihydrochloride IUPAC Name: N-(diaminomethylidene)-4-imidazol-1-yl-2-methyl-5-methylsulfonylbenzamide dihydrochloride Traditional Name: N-(diaminomethylene)-4-imidazol-1-yl-5-mesyl-2-methyl-benzamide dihydrochloride Formula: C13H17Cl2N5O3S MolecularWeight: 394.27678

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(=O)N=C(N)N)S(=O)(=O)C)N2C=CN=C2.Cl.Cl

Isomeric SMILES

CC1=CC(=C(C=C1C(=O)N=C(N)N)S(=O)(=O)C)N2C=CN=C2.Cl.Cl

InChI

InChI=1S/C13H15N5O3S.2ClH/c1-8-5-10(18-4-3-16-7-18)11(22(2,20)21)6-9(8)12(19)17-13(14)15;;/h3-7H,1-2H3,(H4,14,15,17,19);2*1H