2,5-dimethyl-N-[6-(3-oxidanylidenepiperazin-1-yl)pyridin-3-yl]-1-(pyridin-2-ylmethyl)pyrrole-3-carboxamide

Systemtic Name: 2,5-dimethyl-N-[6-(3-oxidanylidenepiperazin-1-yl)pyridin-3-yl]-1-(pyridin-2-ylmethyl)pyrrole-3-carboxamide Openeye Name: 2,5-dimethyl-N-[6-(3-oxopiperazin-1-yl)-3-pyridyl]-1-(2-pyridylmethyl)pyrrole-3-carboxamide CAS Name: 2,5-dimethyl-N-[6-(3-oxo-1-piperazinyl)-3-pyridinyl]-1-(2-pyridinylmethyl)-3-pyrrolecarboxamide IUPAC Name: 2,5-dimethyl-N-[6-(3-oxopiperazin-1-yl)pyridin-3-yl]-1-(pyridin-2-ylmethyl)pyrrole-3-carboxamide Traditional Name: N-[6-(3-ketopiperazino)-3-pyridyl]-2,5-dimethyl-1-(2-pyridylmethyl)pyrrole-3-carboxamide Formula: C22H24N6O2 MolecularWeight: 404.46496

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC2=CC=CC=N2)C)C(=O)NC3=CN=C(C=C3)N4CCNC(=O)C4

Isomeric SMILES

CC1=CC(=C(N1CC2=CC=CC=N2)C)C(=O)NC3=CN=C(C=C3)N4CCNC(=O)C4

InChI

InChI=1S/C22H24N6O2/c1-15-11-19(16(2)28(15)13-18-5-3-4-8-23-18)22(30)26-17-6-7-20(25-12-17)27-10-9-24-21(29)14-27/h3-8,11-12H,9-10,13-14H2,1-2H3,(H,24,29)(H,26,30)