N-[5-(cyanomethylamino)-3-methyl-5-oxidanylidene-pentyl]-3-(3-pyridin-3-ylpropoxy)benzamide

Systemtic Name: N-[5-(cyanomethylamino)-3-methyl-5-oxidanylidene-pentyl]-3-(3-pyridin-3-ylpropoxy)benzamide Openeye Name: N-[5-(cyanomethylamino)-3-methyl-5-oxo-pentyl]-3-[3-(3-pyridyl)propoxy]benzamide CAS Name: N-[5-(cyanomethylamino)-3-methyl-5-oxopentyl]-3-[3-(3-pyridinyl)propoxy]benzamide IUPAC Name: N-[5-(cyanomethylamino)-3-methyl-5-oxopentyl]-3-(3-pyridin-3-ylpropoxy)benzamide Traditional Name: N-[5-(cyanomethylamino)-5-keto-3-methyl-pentyl]-3-[3-(3-pyridyl)propoxy]benzamide Formula: C23H28N4O3 MolecularWeight: 408.49342

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCNC(=O)C1=CC(=CC=C1)OCCCC2=CN=CC=C2)CC(=O)NCC#N

Isomeric SMILES

CC(CCNC(=O)C1=CC(=CC=C1)OCCCC2=CN=CC=C2)CC(=O)NCC#N

InChI

InChI=1S/C23H28N4O3/c1-18(15-22(28)26-13-10-24)9-12-27-23(29)20-7-2-8-21(16-20)30-14-4-6-19-5-3-11-25-17-19/h2-3,5,7-8,11,16-18H,4,6,9,12-15H2,1H3,(H,26,28)(H,27,29)