N-[3-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]pyrazine-2-carboxamide

Systemtic Name: N-[3-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]pyrazine-2-carboxamide Openeye Name: N-[3-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]pyrazine-2-carboxamide CAS Name: N-[3-methyl-4-(4-methyl-1-piperazin-4-iumyl)phenyl]-2-pyrazinecarboxamide IUPAC Name: N-[3-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]pyrazine-2-carboxamide Traditional Name: N-[3-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]pyrazinamide Formula: C17H22N5O+ MolecularWeight: 312.38948

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)C2=NC=CN=C2)N3CC[NH+](CC3)C

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)C2=NC=CN=C2)N3CC[NH+](CC3)C

InChI

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