N-(3-imidazol-1-ylpropyl)-N-[3-(prop-2-enylcarbamoyl)pent-1-en-3-yl]pyridine-3-carboxamide

Systemtic Name: N-(3-imidazol-1-ylpropyl)-N-[3-(prop-2-enylcarbamoyl)pent-1-en-3-yl]pyridine-3-carboxamide Openeye Name: N-[1-(allylcarbamoyl)-1-ethyl-allyl]-N-(3-imidazol-1-ylpropyl)pyridine-3-carboxamide CAS Name: N-[3-(1-imidazolyl)propyl]-N-[3-[oxo-(prop-2-enylamino)methyl]pent-1-en-3-yl]-3-pyridinecarboxamide IUPAC Name: N-(3-imidazol-1-ylpropyl)-N-[3-(prop-2-enylcarbamoyl)pent-1-en-3-yl]pyridine-3-carboxamide Traditional Name: N-[1-(allylcarbamoyl)-1-ethyl-allyl]-N-(3-imidazol-1-ylpropyl)nicotinamide Formula: C21H27N5O2 MolecularWeight: 381.47138

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C=C)(C(=O)NCC=C)N(CCCN1C=CN=C1)C(=O)C2=CN=CC=C2

Isomeric SMILES

CCC(C=C)(C(=O)NCC=C)N(CCCN1C=CN=C1)C(=O)C2=CN=CC=C2

InChI

InChI=1S/C21H27N5O2/c1-4-10-24-20(28)21(5-2,6-3)26(14-8-13-25-15-12-23-17-25)19(27)18-9-7-11-22-16-18/h4-5,7,9,11-12,15-17H,1-2,6,8,10,13-14H2,3H3,(H,24,28)