N-[3-[(3-chloranyl-2-fluoranyl-phenyl)methylsulfonyl]-1-(cyanomethylamino)-1-oxidanylidene-propan-2-yl]benzamide

Systemtic Name: N-[3-[(3-chloranyl-2-fluoranyl-phenyl)methylsulfonyl]-1-(cyanomethylamino)-1-oxidanylidene-propan-2-yl]benzamide Openeye Name: N-[1-[(3-chloro-2-fluoro-phenyl)methylsulfonylmethyl]-2-(cyanomethylamino)-2-oxo-ethyl]benzamide CAS Name: N-[3-[(3-chloro-2-fluorophenyl)methylsulfonyl]-1-(cyanomethylamino)-1-oxopropan-2-yl]benzamide IUPAC Name: N-[3-[(3-chloro-2-fluorophenyl)methylsulfonyl]-1-(cyanomethylamino)-1-oxopropan-2-yl]benzamide Traditional Name: N-[1-[(3-chloro-2-fluoro-benzyl)sulfonylmethyl]-2-(cyanomethylamino)-2-keto-ethyl]benzamide Formula: C19H17ClFN3O4S MolecularWeight: 437.872383

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC(CS(=O)(=O)CC2=C(C(=CC=C2)Cl)F)C(=O)NCC#N

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC(CS(=O)(=O)CC2=C(C(=CC=C2)Cl)F)C(=O)NCC#N

InChI

InChI=1S/C19H17ClFN3O4S/c20-15-8-4-7-14(17(15)21)11-29(27,28)12-16(19(26)23-10-9-22)24-18(25)13-5-2-1-3-6-13/h1-8,16H,10-12H2,(H,23,26)(H,24,25)