[(1S)-2-[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)ethanoylamino]-1-phenyl-ethyl]-diethyl-azanium

Systemtic Name: [(1S)-2-[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)ethanoylamino]-1-phenyl-ethyl]-diethyl-azanium Openeye Name: [(1S)-2-[[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)acetyl]amino]-1-phenyl-ethyl]-diethyl-ammonium CAS Name: [(1S)-2-[[2-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-1-oxoethyl]amino]-1-phenylethyl]-diethylammonium IUPAC Name: [(1S)-2-[[2-(3,5-dimethyl-1-phenylpyrazol-4-yl)acetyl]amino]-1-phenylethyl]-diethylazanium Traditional Name: [(1S)-2-[[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)acetyl]amino]-1-phenyl-ethyl]-diethyl-ammonium Formula: C25H33N4O+ MolecularWeight: 405.55572

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)C(CNC(=O)CC1=C(N(N=C1C)C2=CC=CC=C2)C)C3=CC=CC=C3

Isomeric SMILES

CC[NH+](CC)[C@H](CNC(=O)CC1=C(N(N=C1C)C2=CC=CC=C2)C)C3=CC=CC=C3

InChI

InChI=1S/C25H32N4O/c1-5-28(6-2)24(21-13-9-7-10-14-21)18-26-25(30)17-23-19(3)27-29(20(23)4)22-15-11-8-12-16-22/h7-16,24H,5-6,17-18H2,1-4H3,(H,26,30)/p+1/t24-/m1/s1