2-morpholin-4-ium-4-ylethyl-[(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)methyl]azanium

Systemtic Name: 2-morpholin-4-ium-4-ylethyl-[(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)methyl]azanium Openeye Name: 2-morpholin-4-ium-4-ylethyl-[[1-phenyl-3-(2-thienyl)pyrazol-4-yl]methyl]ammonium CAS Name: 2-(4-morpholin-4-iumyl)ethyl-[(1-phenyl-3-thiophen-2-yl-4-pyrazolyl)methyl]ammonium IUPAC Name: 2-morpholin-4-ium-4-ylethyl-[(1-phenyl-3-thiophen-2-ylpyrazol-4-yl)methyl]azanium Traditional Name: 2-morpholin-4-ium-4-ylethyl-[[1-phenyl-3-(2-thienyl)pyrazol-4-yl]methyl]ammonium Formula: C20H26N4OS+2 MolecularWeight: 370.51164

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC[NH2+]CC2=CN(N=C2C3=CC=CS3)C4=CC=CC=C4

Isomeric SMILES

C1COCC[NH+]1CC[NH2+]CC2=CN(N=C2C3=CC=CS3)C4=CC=CC=C4

InChI

InChI=1S/C20H24N4OS/c1-2-5-18(6-3-1)24-16-17(20(22-24)19-7-4-14-26-19)15-21-8-9-23-10-12-25-13-11-23/h1-7,14,16,21H,8-13,15H2/p+2