N-[(1-cyclopentylpiperidin-1-ium-4-yl)methyl]-2-methyl-N-(pyridin-3-ylmethyl)-1,3-thiazole-4-carboxamide

Systemtic Name: N-[(1-cyclopentylpiperidin-1-ium-4-yl)methyl]-2-methyl-N-(pyridin-3-ylmethyl)-1,3-thiazole-4-carboxamide Openeye Name: N-[(1-cyclopentylpiperidin-1-ium-4-yl)methyl]-2-methyl-N-(3-pyridylmethyl)thiazole-4-carboxamide CAS Name: N-[(1-cyclopentyl-4-piperidin-1-iumyl)methyl]-2-methyl-N-(3-pyridinylmethyl)-4-thiazolecarboxamide IUPAC Name: N-[(1-cyclopentylpiperidin-1-ium-4-yl)methyl]-2-methyl-N-(pyridin-3-ylmethyl)-1,3-thiazole-4-carboxamide Traditional Name: N-[(1-cyclopentylpiperidin-1-ium-4-yl)methyl]-2-methyl-N-(3-pyridylmethyl)thiazole-4-carboxamide Formula: C22H31N4OS+ MolecularWeight: 399.57274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)C(=O)N(CC2CC[NH+](CC2)C3CCCC3)CC4=CN=CC=C4

Isomeric SMILES

CC1=NC(=CS1)C(=O)N(CC2CC[NH+](CC2)C3CCCC3)CC4=CN=CC=C4

InChI

InChI=1S/C22H30N4OS/c1-17-24-21(16-28-17)22(27)26(15-19-5-4-10-23-13-19)14-18-8-11-25(12-9-18)20-6-2-3-7-20/h4-5,10,13,16,18,20H,2-3,6-9,11-12,14-15H2,1H3/p+1