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

Systemtic Name: N-[bis(azanyl)methylidene]-5-methylsulfonyl-4-(4-oxidanylidenepyridin-1-yl)-2-propyl-benzamide Openeye Name: N-(diaminomethylene)-5-methylsulfonyl-4-(4-oxo-1-pyridyl)-2-propyl-benzamide CAS Name: N-(diaminomethylidene)-5-methylsulfonyl-4-(4-oxo-1-pyridinyl)-2-propylbenzamide IUPAC Name: N-(diaminomethylidene)-5-methylsulfonyl-4-(4-oxopyridin-1-yl)-2-propylbenzamide Traditional Name: N-(diaminomethylene)-4-(4-keto-1-pyridyl)-5-mesyl-2-propyl-benzamide Formula: C17H20N4O4S MolecularWeight: 376.4301

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=C(C=C1C(=O)N=C(N)N)S(=O)(=O)C)N2C=CC(=O)C=C2

Isomeric SMILES

CCCC1=CC(=C(C=C1C(=O)N=C(N)N)S(=O)(=O)C)N2C=CC(=O)C=C2

InChI

InChI=1S/C17H20N4O4S/c1-3-4-11-9-14(21-7-5-12(22)6-8-21)15(26(2,24)25)10-13(11)16(23)20-17(18)19/h5-10H,3-4H2,1-2H3,(H4,18,19,20,23)