N-[1-(cyanomethylamino)-4-methyl-1-oxidanylidene-pentan-2-yl]-3-(naphthalen-1-ylsulfonylamino)benzamide

Systemtic Name: N-[1-(cyanomethylamino)-4-methyl-1-oxidanylidene-pentan-2-yl]-3-(naphthalen-1-ylsulfonylamino)benzamide Openeye Name: N-[1-(cyanomethylcarbamoyl)-3-methyl-butyl]-3-(1-naphthylsulfonylamino)benzamide CAS Name: N-[1-(cyanomethylamino)-4-methyl-1-oxopentan-2-yl]-3-(1-naphthalenylsulfonylamino)benzamide IUPAC Name: N-[1-(cyanomethylamino)-4-methyl-1-oxopentan-2-yl]-3-(naphthalen-1-ylsulfonylamino)benzamide Traditional Name: N-[1-(cyanomethylcarbamoyl)-3-methyl-butyl]-3-(1-naphthylsulfonylamino)benzamide Formula: C25H26N4O4S MolecularWeight: 478.56334

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NCC#N)NC(=O)C1=CC(=CC=C1)NS(=O)(=O)C2=CC=CC3=CC=CC=C32

Isomeric SMILES

CC(C)CC(C(=O)NCC#N)NC(=O)C1=CC(=CC=C1)NS(=O)(=O)C2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C25H26N4O4S/c1-17(2)15-22(25(31)27-14-13-26)28-24(30)19-9-5-10-20(16-19)29-34(32,33)23-12-6-8-18-7-3-4-11-21(18)23/h3-12,16-17,22,29H,14-15H2,1-2H3,(H,27,31)(H,28,30)