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

Systemtic Name: 4-ethanoyl-3,5-dimethyl-N-[6-(3-oxidanylidenepiperazin-1-yl)pyridin-3-yl]-1H-pyrrole-2-carboxamide Openeye Name: 4-acetyl-3,5-dimethyl-N-[6-(3-oxopiperazin-1-yl)-3-pyridyl]-1H-pyrrole-2-carboxamide CAS Name: 4-acetyl-3,5-dimethyl-N-[6-(3-oxo-1-piperazinyl)-3-pyridinyl]-1H-pyrrole-2-carboxamide IUPAC Name: 4-acetyl-3,5-dimethyl-N-[6-(3-oxopiperazin-1-yl)pyridin-3-yl]-1H-pyrrole-2-carboxamide Traditional Name: 4-acetyl-N-[6-(3-ketopiperazino)-3-pyridyl]-3,5-dimethyl-1H-pyrrole-2-carboxamide Formula: C18H21N5O3 MolecularWeight: 355.39104

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)C)C)C(=O)NC2=CN=C(C=C2)N3CCNC(=O)C3

Isomeric SMILES

CC1=C(NC(=C1C(=O)C)C)C(=O)NC2=CN=C(C=C2)N3CCNC(=O)C3

InChI

InChI=1S/C18H21N5O3/c1-10-16(12(3)24)11(2)21-17(10)18(26)22-13-4-5-14(20-8-13)23-7-6-19-15(25)9-23/h4-5,8,21H,6-7,9H2,1-3H3,(H,19,25)(H,22,26)