2-phenyl-1-[(propanoylamino)methyl]-N-(pyridin-2-ylmethyl)pyrrole-3-carboxamide

Systemtic Name: 2-phenyl-1-[(propanoylamino)methyl]-N-(pyridin-2-ylmethyl)pyrrole-3-carboxamide Openeye Name: 2-phenyl-1-[(propanoylamino)methyl]-N-(2-pyridylmethyl)pyrrole-3-carboxamide CAS Name: 1-[(1-oxopropylamino)methyl]-2-phenyl-N-(2-pyridinylmethyl)-3-pyrrolecarboxamide IUPAC Name: 2-phenyl-1-[(propanoylamino)methyl]-N-(pyridin-2-ylmethyl)pyrrole-3-carboxamide Traditional Name: 2-phenyl-1-(propionamidomethyl)-N-(2-pyridylmethyl)pyrrole-3-carboxamide Formula: C21H22N4O2 MolecularWeight: 362.42498

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NCN1C=CC(=C1C2=CC=CC=C2)C(=O)NCC3=CC=CC=N3

Isomeric SMILES

CCC(=O)NCN1C=CC(=C1C2=CC=CC=C2)C(=O)NCC3=CC=CC=N3

InChI

InChI=1S/C21H22N4O2/c1-2-19(26)24-15-25-13-11-18(20(25)16-8-4-3-5-9-16)21(27)23-14-17-10-6-7-12-22-17/h3-13H,2,14-15H2,1H3,(H,23,27)(H,24,26)