3-(3,5-dimethylpyrazol-1-yl)-N-[6-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]propanamide

Systemtic Name: 3-(3,5-dimethylpyrazol-1-yl)-N-[6-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]propanamide Openeye Name: 3-(3,5-dimethylpyrazol-1-yl)-N-[6-(4-methylpiperazin-4-ium-1-yl)-3-pyridyl]propanamide CAS Name: 3-(3,5-dimethyl-1-pyrazolyl)-N-[6-(4-methyl-1-piperazin-4-iumyl)-3-pyridinyl]propanamide IUPAC Name: 3-(3,5-dimethylpyrazol-1-yl)-N-[6-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]propanamide Traditional Name: 3-(3,5-dimethylpyrazol-1-yl)-N-[6-(4-methylpiperazin-4-ium-1-yl)-3-pyridyl]propionamide Formula: C18H27N6O+ MolecularWeight: 343.44658

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CCC(=O)NC2=CN=C(C=C2)N3CC[NH+](CC3)C)C

Isomeric SMILES

CC1=CC(=NN1CCC(=O)NC2=CN=C(C=C2)N3CC[NH+](CC3)C)C

InChI

InChI=1S/C18H26N6O/c1-14-12-15(2)24(21-14)7-6-18(25)20-16-4-5-17(19-13-16)23-10-8-22(3)9-11-23/h4-5,12-13H,6-11H2,1-3H3,(H,20,25)/p+1