N-propan-2-yl-1-[1-(thian-4-yl)piperidin-4-yl]piperidin-1-ium-4-carboxamide

Systemtic Name: N-propan-2-yl-1-[1-(thian-4-yl)piperidin-4-yl]piperidin-1-ium-4-carboxamide Openeye Name: N-isopropyl-1-(1-tetrahydrothiopyran-4-yl-4-piperidyl)piperidin-1-ium-4-carboxamide CAS Name: N-propan-2-yl-1-[1-(4-thianyl)-4-piperidinyl]-4-piperidin-1-iumcarboxamide IUPAC Name: N-propan-2-yl-1-[1-(thian-4-yl)piperidin-4-yl]piperidin-1-ium-4-carboxamide Traditional Name: N-isopropyl-1-(1-tetrahydrothiopyran-4-yl-4-piperidyl)piperidin-1-ium-4-carboxamide Formula: C19H36N3OS+ MolecularWeight: 354.57364

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C1CC[NH+](CC1)C2CCN(CC2)C3CCSCC3

Isomeric SMILES

CC(C)NC(=O)C1CC[NH+](CC1)C2CCN(CC2)C3CCSCC3

InChI

InChI=1S/C19H35N3OS/c1-15(2)20-19(23)16-3-9-21(10-4-16)17-5-11-22(12-6-17)18-7-13-24-14-8-18/h15-18H,3-14H2,1-2H3,(H,20,23)/p+1