N-[1-(cyanomethylamino)-1-oxidanylidene-3-pyridin-2-ylcarbonylsulfonyl-propan-2-yl]benzamide

Systemtic Name: N-[1-(cyanomethylamino)-1-oxidanylidene-3-pyridin-2-ylcarbonylsulfonyl-propan-2-yl]benzamide Openeye Name: N-[2-(cyanomethylamino)-2-oxo-1-(pyridine-2-carbonylsulfonylmethyl)ethyl]benzamide CAS Name: N-[1-(cyanomethylamino)-1-oxo-3-[oxo(2-pyridinyl)methyl]sulfonylpropan-2-yl]benzamide IUPAC Name: N-[1-(cyanomethylamino)-1-oxo-3-(pyridine-2-carbonylsulfonyl)propan-2-yl]benzamide Traditional Name: N-[2-(cyanomethylamino)-2-keto-1-(picolinoylsulfonylmethyl)ethyl]benzamide Formula: C18H16N4O5S MolecularWeight: 400.40844

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC(CS(=O)(=O)C(=O)C2=CC=CC=N2)C(=O)NCC#N

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC(CS(=O)(=O)C(=O)C2=CC=CC=N2)C(=O)NCC#N

InChI

InChI=1S/C18H16N4O5S/c19-9-11-21-17(24)15(22-16(23)13-6-2-1-3-7-13)12-28(26,27)18(25)14-8-4-5-10-20-14/h1-8,10,15H,11-12H2,(H,21,24)(H,22,23)