4-(2-cyanoethanoylamino)-N-(3-imidazol-1-ylpropyl)benzamide

Systemtic Name: 4-(2-cyanoethanoylamino)-N-(3-imidazol-1-ylpropyl)benzamide Openeye Name: 4-[(2-cyanoacetyl)amino]-N-(3-imidazol-1-ylpropyl)benzamide CAS Name: 4-[(2-cyano-1-oxoethyl)amino]-N-[3-(1-imidazolyl)propyl]benzamide IUPAC Name: 4-[(2-cyanoacetyl)amino]-N-(3-imidazol-1-ylpropyl)benzamide Traditional Name: 4-[(2-cyanoacetyl)amino]-N-(3-imidazol-1-ylpropyl)benzamide Formula: C16H17N5O2 MolecularWeight: 311.33848

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NCCCN2C=CN=C2)NC(=O)CC#N

Isomeric SMILES

C1=CC(=CC=C1C(=O)NCCCN2C=CN=C2)NC(=O)CC#N

InChI

InChI=1S/C16H17N5O2/c17-7-6-15(22)20-14-4-2-13(3-5-14)16(23)19-8-1-10-21-11-9-18-12-21/h2-5,9,11-12H,1,6,8,10H2,(H,19,23)(H,20,22)