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

Systemtic Name: N-[1-(cyanomethylamino)-4-methyl-1-oxidanylidene-pentan-2-yl]-3-(pyridin-3-ylsulfonylamino)benzamide Openeye Name: N-[1-(cyanomethylcarbamoyl)-3-methyl-butyl]-3-(3-pyridylsulfonylamino)benzamide CAS Name: N-[1-(cyanomethylamino)-4-methyl-1-oxopentan-2-yl]-3-(3-pyridinylsulfonylamino)benzamide IUPAC Name: N-[1-(cyanomethylamino)-4-methyl-1-oxopentan-2-yl]-3-(pyridin-3-ylsulfonylamino)benzamide Traditional Name: N-[1-(cyanomethylcarbamoyl)-3-methyl-butyl]-3-(3-pyridylsulfonylamino)benzamide Formula: C20H23N5O4S MolecularWeight: 429.49272

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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=CN=CC=C2

Isomeric SMILES

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

InChI

InChI=1S/C20H23N5O4S/c1-14(2)11-18(20(27)23-10-8-21)24-19(26)15-5-3-6-16(12-15)25-30(28,29)17-7-4-9-22-13-17/h3-7,9,12-14,18,25H,10-11H2,1-2H3,(H,23,27)(H,24,26)