N-[5-(cyanomethylamino)-3-methyl-5-oxidanylidene-pentyl]-4-(3-pyridin-4-ylpropoxy)benzamide

Systemtic Name: N-[5-(cyanomethylamino)-3-methyl-5-oxidanylidene-pentyl]-4-(3-pyridin-4-ylpropoxy)benzamide Openeye Name: N-[5-(cyanomethylamino)-3-methyl-5-oxo-pentyl]-4-[3-(4-pyridyl)propoxy]benzamide CAS Name: N-[5-(cyanomethylamino)-3-methyl-5-oxopentyl]-4-(3-pyridin-4-ylpropoxy)benzamide IUPAC Name: N-[5-(cyanomethylamino)-3-methyl-5-oxopentyl]-4-(3-pyridin-4-ylpropoxy)benzamide Traditional Name: N-[5-(cyanomethylamino)-5-keto-3-methyl-pentyl]-4-[3-(4-pyridyl)propoxy]benzamide Formula: C23H28N4O3 MolecularWeight: 408.49342

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H28N4O3/c1-18(17-22(28)26-15-11-24)8-14-27-23(29)20-4-6-21(7-5-20)30-16-2-3-19-9-12-25-13-10-19/h4-7,9-10,12-13,18H,2-3,8,14-17H2,1H3,(H,26,28)(H,27,29)