N-[(1-cyclopentylpiperidin-1-ium-4-yl)methyl]-N-(pyridin-3-ylmethyl)thiophene-3-carboxamide

Systemtic Name: N-[(1-cyclopentylpiperidin-1-ium-4-yl)methyl]-N-(pyridin-3-ylmethyl)thiophene-3-carboxamide Openeye Name: N-[(1-cyclopentylpiperidin-1-ium-4-yl)methyl]-N-(3-pyridylmethyl)thiophene-3-carboxamide CAS Name: N-[(1-cyclopentyl-4-piperidin-1-iumyl)methyl]-N-(3-pyridinylmethyl)-3-thiophenecarboxamide IUPAC Name: N-[(1-cyclopentylpiperidin-1-ium-4-yl)methyl]-N-(pyridin-3-ylmethyl)thiophene-3-carboxamide Traditional Name: N-[(1-cyclopentylpiperidin-1-ium-4-yl)methyl]-N-(3-pyridylmethyl)thiophene-3-carboxamide Formula: C22H30N3OS+ MolecularWeight: 384.5581

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)[NH+]2CCC(CC2)CN(CC3=CN=CC=C3)C(=O)C4=CSC=C4

Isomeric SMILES

C1CCC(C1)[NH+]2CCC(CC2)CN(CC3=CN=CC=C3)C(=O)C4=CSC=C4

InChI

InChI=1S/C22H29N3OS/c26-22(20-9-13-27-17-20)25(16-19-4-3-10-23-14-19)15-18-7-11-24(12-8-18)21-5-1-2-6-21/h3-4,9-10,13-14,17-18,21H,1-2,5-8,11-12,15-16H2/p+1