N-cyclopropyl-N-[(1R)-2-phenyl-1-[1-(thiophen-2-ylmethyl)piperidin-1-ium-4-yl]ethyl]pyridine-2-carboxamide

Systemtic Name: N-cyclopropyl-N-[(1R)-2-phenyl-1-[1-(thiophen-2-ylmethyl)piperidin-1-ium-4-yl]ethyl]pyridine-2-carboxamide Openeye Name: N-cyclopropyl-N-[(1R)-2-phenyl-1-[1-(2-thienylmethyl)piperidin-1-ium-4-yl]ethyl]pyridine-2-carboxamide CAS Name: N-cyclopropyl-N-[(1R)-2-phenyl-1-[1-(thiophen-2-ylmethyl)-4-piperidin-1-iumyl]ethyl]-2-pyridinecarboxamide IUPAC Name: N-cyclopropyl-N-[(1R)-2-phenyl-1-[1-(thiophen-2-ylmethyl)piperidin-1-ium-4-yl]ethyl]pyridine-2-carboxamide Traditional Name: N-cyclopropyl-N-[(1R)-2-phenyl-1-[1-(2-thenyl)piperidin-1-ium-4-yl]ethyl]picolinamide Formula: C27H32N3OS+ MolecularWeight: 446.62748

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N(C(CC2=CC=CC=C2)C3CC[NH+](CC3)CC4=CC=CS4)C(=O)C5=CC=CC=N5

Isomeric SMILES

C1CC1N([C@H](CC2=CC=CC=C2)C3CC[NH+](CC3)CC4=CC=CS4)C(=O)C5=CC=CC=N5

InChI

InChI=1S/C27H31N3OS/c31-27(25-10-4-5-15-28-25)30(23-11-12-23)26(19-21-7-2-1-3-8-21)22-13-16-29(17-14-22)20-24-9-6-18-32-24/h1-10,15,18,22-23,26H,11-14,16-17,19-20H2/p+1/t26-/m1/s1