N-cyclohexyl-2-oxidanyl-2-[1-[1-(2-pyridin-4-ylethanethioyl)pyrrolidin-2-yl]carbonylpyrrolidin-1-ium-1-yl]ethanamide

Systemtic Name: N-cyclohexyl-2-oxidanyl-2-[1-[1-(2-pyridin-4-ylethanethioyl)pyrrolidin-2-yl]carbonylpyrrolidin-1-ium-1-yl]ethanamide Openeye Name: N-cyclohexyl-2-hydroxy-2-[1-[1-[2-(4-pyridyl)ethanethioyl]pyrrolidine-2-carbonyl]pyrrolidin-1-ium-1-yl]acetamide CAS Name: N-cyclohexyl-2-hydroxy-2-[1-[oxo-[1-(2-pyridin-4-yl-1-sulfanylideneethyl)-2-pyrrolidinyl]methyl]-1-pyrrolidin-1-iumyl]acetamide IUPAC Name: N-cyclohexyl-2-hydroxy-2-[1-[1-(2-pyridin-4-ylethanethioyl)pyrrolidine-2-carbonyl]pyrrolidin-1-ium-1-yl]acetamide Traditional Name: N-cyclohexyl-2-hydroxy-2-[1-[1-[2-(4-pyridyl)thioacetyl]prolyl]pyrrolidin-1-ium-1-yl]acetamide Formula: C24H35N4O3S+ MolecularWeight: 459.6247

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)C([N+]2(CCCC2)C(=O)C3CCCN3C(=S)CC4=CC=NC=C4)O

Isomeric SMILES

C1CCC(CC1)NC(=O)C([N+]2(CCCC2)C(=O)C3CCCN3C(=S)CC4=CC=NC=C4)O

InChI

InChI=1S/C24H34N4O3S/c29-22(26-19-7-2-1-3-8-19)24(31)28(15-4-5-16-28)23(30)20-9-6-14-27(20)21(32)17-18-10-12-25-13-11-18/h10-13,19-20,24,31H,1-9,14-17H2/p+1