3-(5-cyano-2,4-dimethyl-6-oxidanylidene-1H-pyridin-3-yl)-N-[4-(4-ethylpiperazin-4-ium-1-yl)-3-methyl-phenyl]propanamide

Systemtic Name: 3-(5-cyano-2,4-dimethyl-6-oxidanylidene-1H-pyridin-3-yl)-N-[4-(4-ethylpiperazin-4-ium-1-yl)-3-methyl-phenyl]propanamide Openeye Name: 3-(5-cyano-2,4-dimethyl-6-oxo-1H-pyridin-3-yl)-N-[4-(4-ethylpiperazin-4-ium-1-yl)-3-methyl-phenyl]propanamide CAS Name: 3-(5-cyano-2,4-dimethyl-6-oxo-1H-pyridin-3-yl)-N-[4-(4-ethyl-1-piperazin-4-iumyl)-3-methylphenyl]propanamide IUPAC Name: 3-(5-cyano-2,4-dimethyl-6-oxo-1H-pyridin-3-yl)-N-[4-(4-ethylpiperazin-4-ium-1-yl)-3-methylphenyl]propanamide Traditional Name: 3-(5-cyano-6-keto-2,4-dimethyl-1H-pyridin-3-yl)-N-[4-(4-ethylpiperazin-4-ium-1-yl)-3-methyl-phenyl]propionamide Formula: C24H32N5O2+ MolecularWeight: 422.54318

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=C(C=C(C=C2)NC(=O)CCC3=C(NC(=O)C(=C3C)C#N)C)C

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=C(C=C(C=C2)NC(=O)CCC3=C(NC(=O)C(=C3C)C#N)C)C

InChI

InChI=1S/C24H31N5O2/c1-5-28-10-12-29(13-11-28)22-8-6-19(14-16(22)2)27-23(30)9-7-20-17(3)21(15-25)24(31)26-18(20)4/h6,8,14H,5,7,9-13H2,1-4H3,(H,26,31)(H,27,30)/p+1