4,5-bis(chloranyl)-N-[3-(pyridin-3-ylmethylamino)propyl]-1H-pyrrole-2-carboxamide

Systemtic Name: 4,5-bis(chloranyl)-N-[3-(pyridin-3-ylmethylamino)propyl]-1H-pyrrole-2-carboxamide Openeye Name: 4,5-dichloro-N-[3-(3-pyridylmethylamino)propyl]-1H-pyrrole-2-carboxamide CAS Name: 4,5-dichloro-N-[3-(3-pyridinylmethylamino)propyl]-1H-pyrrole-2-carboxamide IUPAC Name: 4,5-dichloro-N-[3-(pyridin-3-ylmethylamino)propyl]-1H-pyrrole-2-carboxamide Traditional Name: 4,5-dichloro-N-[3-(3-pyridylmethylamino)propyl]-1H-pyrrole-2-carboxamide Formula: C14H16Cl2N4O MolecularWeight: 327.20904

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CNCCCNC(=O)C2=CC(=C(N2)Cl)Cl

Isomeric SMILES

C1=CC(=CN=C1)CNCCCNC(=O)C2=CC(=C(N2)Cl)Cl

InChI

InChI=1S/C14H16Cl2N4O/c15-11-7-12(20-13(11)16)14(21)19-6-2-5-18-9-10-3-1-4-17-8-10/h1,3-4,7-8,18,20H,2,5-6,9H2,(H,19,21)