N-[bis(azanyl)methylidene]-2-ethyl-5-methylsulfonyl-4-(4-oxidanylidenepyridin-1-yl)benzamide hydrochloride

Systemtic Name: N-[bis(azanyl)methylidene]-2-ethyl-5-methylsulfonyl-4-(4-oxidanylidenepyridin-1-yl)benzamide hydrochloride Openeye Name: N-(diaminomethylene)-2-ethyl-5-methylsulfonyl-4-(4-oxo-1-pyridyl)benzamide hydrochloride CAS Name: N-(diaminomethylidene)-2-ethyl-5-methylsulfonyl-4-(4-oxo-1-pyridinyl)benzamide hydrochloride IUPAC Name: N-(diaminomethylidene)-2-ethyl-5-methylsulfonyl-4-(4-oxopyridin-1-yl)benzamide hydrochloride Traditional Name: N-(diaminomethylene)-2-ethyl-4-(4-keto-1-pyridyl)-5-mesyl-benzamide hydrochloride Formula: C16H19ClN4O4S MolecularWeight: 398.86446

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1C(=O)N=C(N)N)S(=O)(=O)C)N2C=CC(=O)C=C2.Cl

Isomeric SMILES

CCC1=CC(=C(C=C1C(=O)N=C(N)N)S(=O)(=O)C)N2C=CC(=O)C=C2.Cl

InChI

InChI=1S/C16H18N4O4S.ClH/c1-3-10-8-13(20-6-4-11(21)5-7-20)14(25(2,23)24)9-12(10)15(22)19-16(17)18;/h4-9H,3H2,1-2H3,(H4,17,18,19,22);1H