N-[(2R)-1-(cyanomethylamino)-3-[(3-iodanylphenyl)methylsulfonyl]-1-oxidanylidene-propan-2-yl]benzamide

Systemtic Name: N-[(2R)-1-(cyanomethylamino)-3-[(3-iodanylphenyl)methylsulfonyl]-1-oxidanylidene-propan-2-yl]benzamide Openeye Name: N-[(1R)-2-(cyanomethylamino)-1-[(3-iodophenyl)methylsulfonylmethyl]-2-oxo-ethyl]benzamide CAS Name: N-[(2R)-1-(cyanomethylamino)-3-[(3-iodophenyl)methylsulfonyl]-1-oxopropan-2-yl]benzamide IUPAC Name: N-[(2R)-1-(cyanomethylamino)-3-[(3-iodophenyl)methylsulfonyl]-1-oxopropan-2-yl]benzamide Traditional Name: N-[(1R)-2-(cyanomethylamino)-1-[(3-iodobenzyl)sulfonylmethyl]-2-keto-ethyl]benzamide Formula: C19H18IN3O4S MolecularWeight: 511.33339

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C1=CC=C(C=C1)C(=O)N[C@@H](CS(=O)(=O)CC2=CC(=CC=C2)I)C(=O)NCC#N

InChI

InChI=1S/C19H18IN3O4S/c20-16-8-4-5-14(11-16)12-28(26,27)13-17(19(25)22-10-9-21)23-18(24)15-6-2-1-3-7-15/h1-8,11,17H,10,12-13H2,(H,22,25)(H,23,24)/t17-/m0/s1