N-[3-[(3-cyano-6-methyl-quinolin-1-ium-2-yl)amino]propyl]pyrazine-2-carboxamide

Systemtic Name: N-[3-[(3-cyano-6-methyl-quinolin-1-ium-2-yl)amino]propyl]pyrazine-2-carboxamide Openeye Name: N-[3-[(3-cyano-6-methyl-quinolin-1-ium-2-yl)amino]propyl]pyrazine-2-carboxamide CAS Name: N-[3-[(3-cyano-6-methyl-2-quinolin-1-iumyl)amino]propyl]-2-pyrazinecarboxamide IUPAC Name: N-[3-[(3-cyano-6-methylquinolin-1-ium-2-yl)amino]propyl]pyrazine-2-carboxamide Traditional Name: N-[3-[(3-cyano-6-methyl-quinolin-1-ium-2-yl)amino]propyl]pyrazinamide Formula: C19H19N6O+ MolecularWeight: 347.39376

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)[NH+]=C(C(=C2)C#N)NCCCNC(=O)C3=NC=CN=C3

Isomeric SMILES

CC1=CC2=C(C=C1)[NH+]=C(C(=C2)C#N)NCCCNC(=O)C3=NC=CN=C3

InChI

InChI=1S/C19H18N6O/c1-13-3-4-16-14(9-13)10-15(11-20)18(25-16)23-5-2-6-24-19(26)17-12-21-7-8-22-17/h3-4,7-10,12H,2,5-6H2,1H3,(H,23,25)(H,24,26)/p+1