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

Systemtic Name: 2,5-dimethyl-N-[6-(3-oxidanylidenepiperazin-1-yl)pyridin-3-yl]-1-(phenylmethyl)pyrrole-3-carboxamide Openeye Name: 1-benzyl-2,5-dimethyl-N-[6-(3-oxopiperazin-1-yl)-3-pyridyl]pyrrole-3-carboxamide CAS Name: 2,5-dimethyl-N-[6-(3-oxo-1-piperazinyl)-3-pyridinyl]-1-(phenylmethyl)-3-pyrrolecarboxamide IUPAC Name: 1-benzyl-2,5-dimethyl-N-[6-(3-oxopiperazin-1-yl)pyridin-3-yl]pyrrole-3-carboxamide Traditional Name: 1-benzyl-N-[6-(3-ketopiperazino)-3-pyridyl]-2,5-dimethyl-pyrrole-3-carboxamide Formula: C23H25N5O2 MolecularWeight: 403.4769

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC2=CC=CC=C2)C)C(=O)NC3=CN=C(C=C3)N4CCNC(=O)C4

Isomeric SMILES

CC1=CC(=C(N1CC2=CC=CC=C2)C)C(=O)NC3=CN=C(C=C3)N4CCNC(=O)C4

InChI

InChI=1S/C23H25N5O2/c1-16-12-20(17(2)28(16)14-18-6-4-3-5-7-18)23(30)26-19-8-9-21(25-13-19)27-11-10-24-22(29)15-27/h3-9,12-13H,10-11,14-15H2,1-2H3,(H,24,29)(H,26,30)