N-[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]pyrazine-2-carboxamide

Systemtic Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]pyrazine-2-carboxamide Openeye Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]pyrazine-2-carboxamide CAS Name: N-[4-(4-ethyl-1-piperazin-4-iumyl)phenyl]-2-pyrazinecarboxamide IUPAC Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]pyrazine-2-carboxamide Traditional Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]pyrazinamide Formula: C17H22N5O+ MolecularWeight: 312.38948

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3=NC=CN=C3

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3=NC=CN=C3

InChI

InChI=1S/C17H21N5O/c1-2-21-9-11-22(12-10-21)15-5-3-14(4-6-15)20-17(23)16-13-18-7-8-19-16/h3-8,13H,2,9-12H2,1H3,(H,20,23)/p+1