4-ethanoyl-N-[6-(3-oxidanylidenepiperazin-1-yl)pyridin-3-yl]-1H-pyrrole-2-carboxamide

Systemtic Name: 4-ethanoyl-N-[6-(3-oxidanylidenepiperazin-1-yl)pyridin-3-yl]-1H-pyrrole-2-carboxamide Openeye Name: 4-acetyl-N-[6-(3-oxopiperazin-1-yl)-3-pyridyl]-1H-pyrrole-2-carboxamide CAS Name: 4-acetyl-N-[6-(3-oxo-1-piperazinyl)-3-pyridinyl]-1H-pyrrole-2-carboxamide IUPAC Name: 4-acetyl-N-[6-(3-oxopiperazin-1-yl)pyridin-3-yl]-1H-pyrrole-2-carboxamide Traditional Name: 4-acetyl-N-[6-(3-ketopiperazino)-3-pyridyl]-1H-pyrrole-2-carboxamide Formula: C16H17N5O3 MolecularWeight: 327.33788

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CNC(=C1)C(=O)NC2=CN=C(C=C2)N3CCNC(=O)C3

Isomeric SMILES

CC(=O)C1=CNC(=C1)C(=O)NC2=CN=C(C=C2)N3CCNC(=O)C3

InChI

InChI=1S/C16H17N5O3/c1-10(22)11-6-13(18-7-11)16(24)20-12-2-3-14(19-8-12)21-5-4-17-15(23)9-21/h2-3,6-8,18H,4-5,9H2,1H3,(H,17,23)(H,20,24)