N-methyl-N-[(1R)-2-phenyl-1-[1-[(5-phenyl-1H-pyrazol-4-yl)methyl]piperidin-1-ium-4-yl]ethyl]thiophene-3-carboxamide

Systemtic Name: N-methyl-N-[(1R)-2-phenyl-1-[1-[(5-phenyl-1H-pyrazol-4-yl)methyl]piperidin-1-ium-4-yl]ethyl]thiophene-3-carboxamide Openeye Name: N-methyl-N-[(1R)-2-phenyl-1-[1-[(5-phenyl-1H-pyrazol-4-yl)methyl]piperidin-1-ium-4-yl]ethyl]thiophene-3-carboxamide CAS Name: N-methyl-N-[(1R)-2-phenyl-1-[1-[(5-phenyl-1H-pyrazol-4-yl)methyl]-4-piperidin-1-iumyl]ethyl]-3-thiophenecarboxamide IUPAC Name: N-methyl-N-[(1R)-2-phenyl-1-[1-[(5-phenyl-1H-pyrazol-4-yl)methyl]piperidin-1-ium-4-yl]ethyl]thiophene-3-carboxamide Traditional Name: N-methyl-N-[(1R)-2-phenyl-1-[1-[(5-phenyl-1H-pyrazol-4-yl)methyl]piperidin-1-ium-4-yl]ethyl]thiophene-3-carboxamide Formula: C29H33N4OS+ MolecularWeight: 485.66352

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(CC1=CC=CC=C1)C2CC[NH+](CC2)CC3=C(NN=C3)C4=CC=CC=C4)C(=O)C5=CSC=C5

Isomeric SMILES

CN([C@H](CC1=CC=CC=C1)C2CC[NH+](CC2)CC3=C(NN=C3)C4=CC=CC=C4)C(=O)C5=CSC=C5

InChI

InChI=1S/C29H32N4OS/c1-32(29(34)25-14-17-35-21-25)27(18-22-8-4-2-5-9-22)23-12-15-33(16-13-23)20-26-19-30-31-28(26)24-10-6-3-7-11-24/h2-11,14,17,19,21,23,27H,12-13,15-16,18,20H2,1H3,(H,30,31)/p+1/t27-/m1/s1