dimethyl-[(2S)-2-phenyl-2-[(1-phenyl-3-pyridin-3-yl-pyrazol-4-yl)carbonylamino]ethyl]azanium

Systemtic Name: dimethyl-[(2S)-2-phenyl-2-[(1-phenyl-3-pyridin-3-yl-pyrazol-4-yl)carbonylamino]ethyl]azanium Openeye Name: dimethyl-[(2S)-2-phenyl-2-[[1-phenyl-3-(3-pyridyl)pyrazole-4-carbonyl]amino]ethyl]ammonium CAS Name: dimethyl-[(2S)-2-[[oxo-[1-phenyl-3-(3-pyridinyl)-4-pyrazolyl]methyl]amino]-2-phenylethyl]ammonium IUPAC Name: dimethyl-[(2S)-2-phenyl-2-[(1-phenyl-3-pyridin-3-ylpyrazole-4-carbonyl)amino]ethyl]azanium Traditional Name: dimethyl-[(2S)-2-phenyl-2-[[1-phenyl-3-(3-pyridyl)pyrazole-4-carbonyl]amino]ethyl]ammonium Formula: C25H26N5O+ MolecularWeight: 412.50684

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC(C1=CC=CC=C1)NC(=O)C2=CN(N=C2C3=CN=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C[NH+](C)C[C@H](C1=CC=CC=C1)NC(=O)C2=CN(N=C2C3=CN=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H25N5O/c1-29(2)18-23(19-10-5-3-6-11-19)27-25(31)22-17-30(21-13-7-4-8-14-21)28-24(22)20-12-9-15-26-16-20/h3-17,23H,18H2,1-2H3,(H,27,31)/p+1/t23-/m1/s1