4-(cyanomethylsulfonylmethyl)-N-[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl]-N-methyl-benzamide

Systemtic Name: 4-(cyanomethylsulfonylmethyl)-N-[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl]-N-methyl-benzamide Openeye Name: 4-(cyanomethylsulfonylmethyl)-N-[2-(4-fluoroanilino)-2-oxo-ethyl]-N-methyl-benzamide CAS Name: 4-(cyanomethylsulfonylmethyl)-N-[2-(4-fluoroanilino)-2-oxoethyl]-N-methylbenzamide IUPAC Name: 4-(cyanomethylsulfonylmethyl)-N-[2-(4-fluoroanilino)-2-oxoethyl]-N-methylbenzamide Traditional Name: 4-(cyanomethylsulfonylmethyl)-N-[2-(4-fluoroanilino)-2-keto-ethyl]-N-methyl-benzamide Formula: C19H18FN3O4S MolecularWeight: 403.427323

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NC1=CC=C(C=C1)F)C(=O)C2=CC=C(C=C2)CS(=O)(=O)CC#N

Isomeric SMILES

CN(CC(=O)NC1=CC=C(C=C1)F)C(=O)C2=CC=C(C=C2)CS(=O)(=O)CC#N

InChI

InChI=1S/C19H18FN3O4S/c1-23(12-18(24)22-17-8-6-16(20)7-9-17)19(25)15-4-2-14(3-5-15)13-28(26,27)11-10-21/h2-9H,11-13H2,1H3,(H,22,24)