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

Systemtic Name: N-[1-(cyanomethylamino)-4-methyl-1-oxidanylidene-pentan-2-yl]-3-(furan-2-ylmethylcarbamoylamino)benzamide Openeye Name: N-[1-(cyanomethylcarbamoyl)-3-methyl-butyl]-3-(2-furylmethylcarbamoylamino)benzamide CAS Name: N-[1-(cyanomethylamino)-4-methyl-1-oxopentan-2-yl]-3-[[(2-furanylmethylamino)-oxomethyl]amino]benzamide IUPAC Name: N-[1-(cyanomethylamino)-4-methyl-1-oxopentan-2-yl]-3-(furan-2-ylmethylcarbamoylamino)benzamide Traditional Name: N-[1-(cyanomethylcarbamoyl)-3-methyl-butyl]-3-(2-furfurylcarbamoylamino)benzamide Formula: C21H25N5O4 MolecularWeight: 411.4543

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NCC#N)NC(=O)C1=CC(=CC=C1)NC(=O)NCC2=CC=CO2

Isomeric SMILES

CC(C)CC(C(=O)NCC#N)NC(=O)C1=CC(=CC=C1)NC(=O)NCC2=CC=CO2

InChI

InChI=1S/C21H25N5O4/c1-14(2)11-18(20(28)23-9-8-22)26-19(27)15-5-3-6-16(12-15)25-21(29)24-13-17-7-4-10-30-17/h3-7,10,12,14,18H,9,11,13H2,1-2H3,(H,23,28)(H,26,27)(H2,24,25,29)