N-[(2R)-2-morpholin-4-ium-4-yl-2-thiophen-2-yl-ethyl]-1-phenyl-3-pyridin-3-yl-pyrazole-4-carboxamide

Systemtic Name: N-[(2R)-2-morpholin-4-ium-4-yl-2-thiophen-2-yl-ethyl]-1-phenyl-3-pyridin-3-yl-pyrazole-4-carboxamide Openeye Name: N-[(2R)-2-morpholin-4-ium-4-yl-2-(2-thienyl)ethyl]-1-phenyl-3-(3-pyridyl)pyrazole-4-carboxamide CAS Name: N-[(2R)-2-(4-morpholin-4-iumyl)-2-thiophen-2-ylethyl]-1-phenyl-3-(3-pyridinyl)-4-pyrazolecarboxamide IUPAC Name: N-[(2R)-2-morpholin-4-ium-4-yl-2-thiophen-2-ylethyl]-1-phenyl-3-pyridin-3-ylpyrazole-4-carboxamide Traditional Name: N-[(2R)-2-morpholin-4-ium-4-yl-2-(2-thienyl)ethyl]-1-phenyl-3-(3-pyridyl)pyrazole-4-carboxamide Formula: C25H26N5O2S+ MolecularWeight: 460.57124

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1C(CNC(=O)C2=CN(N=C2C3=CN=CC=C3)C4=CC=CC=C4)C5=CC=CS5

Isomeric SMILES

C1COCC[NH+]1[C@H](CNC(=O)C2=CN(N=C2C3=CN=CC=C3)C4=CC=CC=C4)C5=CC=CS5

InChI

InChI=1S/C25H25N5O2S/c31-25(27-17-22(23-9-5-15-33-23)29-11-13-32-14-12-29)21-18-30(20-7-2-1-3-8-20)28-24(21)19-6-4-10-26-16-19/h1-10,15-16,18,22H,11-14,17H2,(H,27,31)/p+1/t22-/m1/s1