[5-[2-(3,5-dimethylpyrazol-1-yl)ethylcarbamoyl]-6-oxidanylidene-1H-pyridin-2-yl]methyl-diethyl-azanium

Systemtic Name: [5-[2-(3,5-dimethylpyrazol-1-yl)ethylcarbamoyl]-6-oxidanylidene-1H-pyridin-2-yl]methyl-diethyl-azanium Openeye Name: [5-[2-(3,5-dimethylpyrazol-1-yl)ethylcarbamoyl]-6-oxo-1H-pyridin-2-yl]methyl-diethyl-ammonium CAS Name: [5-[[2-(3,5-dimethyl-1-pyrazolyl)ethylamino]-oxomethyl]-6-oxo-1H-pyridin-2-yl]methyl-diethylammonium IUPAC Name: [5-[2-(3,5-dimethylpyrazol-1-yl)ethylcarbamoyl]-6-oxo-1H-pyridin-2-yl]methyl-diethylazanium Traditional Name: [5-[2-(3,5-dimethylpyrazol-1-yl)ethylcarbamoyl]-6-keto-1H-pyridin-2-yl]methyl-diethyl-ammonium Formula: C18H28N5O2+ MolecularWeight: 346.44722

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC1=CC=C(C(=O)N1)C(=O)NCCN2C(=CC(=N2)C)C

Isomeric SMILES

CC[NH+](CC)CC1=CC=C(C(=O)N1)C(=O)NCCN2C(=CC(=N2)C)C

InChI

InChI=1S/C18H27N5O2/c1-5-22(6-2)12-15-7-8-16(18(25)20-15)17(24)19-9-10-23-14(4)11-13(3)21-23/h7-8,11H,5-6,9-10,12H2,1-4H3,(H,19,24)(H,20,25)/p+1