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

Systemtic Name: 3-azanyl-N-[4-(4-ethylpiperazin-4-ium-1-yl)-3-methyl-phenyl]pyrazine-2-carboxamide Openeye Name: 3-amino-N-[4-(4-ethylpiperazin-4-ium-1-yl)-3-methyl-phenyl]pyrazine-2-carboxamide CAS Name: 3-amino-N-[4-(4-ethyl-1-piperazin-4-iumyl)-3-methylphenyl]-2-pyrazinecarboxamide IUPAC Name: 3-amino-N-[4-(4-ethylpiperazin-4-ium-1-yl)-3-methylphenyl]pyrazine-2-carboxamide Traditional Name: 3-amino-N-[4-(4-ethylpiperazin-4-ium-1-yl)-3-methyl-phenyl]pyrazinamide Formula: C18H25N6O+ MolecularWeight: 341.4307

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=NC=CN=C3N)C

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=NC=CN=C3N)C

InChI

InChI=1S/C18H24N6O/c1-3-23-8-10-24(11-9-23)15-5-4-14(12-13(15)2)22-18(25)16-17(19)21-7-6-20-16/h4-7,12H,3,8-11H2,1-2H3,(H2,19,21)(H,22,25)/p+1