dimethyl-[2-[6-methyl-4-oxidanylidene-2-phenethyl-3-[(1,3,5-trimethylpyrazol-4-yl)methylcarbamoyl]pyridin-1-yl]ethyl]azanium

Systemtic Name: dimethyl-[2-[6-methyl-4-oxidanylidene-2-phenethyl-3-[(1,3,5-trimethylpyrazol-4-yl)methylcarbamoyl]pyridin-1-yl]ethyl]azanium Openeye Name: dimethyl-[2-[6-methyl-4-oxo-2-phenethyl-3-[(1,3,5-trimethylpyrazol-4-yl)methylcarbamoyl]-1-pyridyl]ethyl]ammonium CAS Name: dimethyl-[2-[6-methyl-4-oxo-3-[oxo-[(1,3,5-trimethyl-4-pyrazolyl)methylamino]methyl]-2-phenethyl-1-pyridinyl]ethyl]ammonium IUPAC Name: dimethyl-[2-[6-methyl-4-oxo-2-phenethyl-3-[(1,3,5-trimethylpyrazol-4-yl)methylcarbamoyl]pyridin-1-yl]ethyl]azanium Traditional Name: 2-[4-keto-6-methyl-2-phenethyl-3-[(1,3,5-trimethylpyrazol-4-yl)methylcarbamoyl]-1-pyridyl]ethyl-dimethyl-ammonium Formula: C26H36N5O2+ MolecularWeight: 450.59634

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=C(N1CC[NH+](C)C)CCC2=CC=CC=C2)C(=O)NCC3=C(N(N=C3C)C)C

Isomeric SMILES

CC1=CC(=O)C(=C(N1CC[NH+](C)C)CCC2=CC=CC=C2)C(=O)NCC3=C(N(N=C3C)C)C

InChI

InChI=1S/C26H35N5O2/c1-18-16-24(32)25(26(33)27-17-22-19(2)28-30(6)20(22)3)23(31(18)15-14-29(4)5)13-12-21-10-8-7-9-11-21/h7-11,16H,12-15,17H2,1-6H3,(H,27,33)/p+1