4-fluoranyl-1-[2-[(1-propan-2-ylsulfonylpyrrolidin-1-ium-1-yl)amino]ethanoyl]pyrrolidine-2-carbonitrile hydrochloride

Systemtic Name: 4-fluoranyl-1-[2-[(1-propan-2-ylsulfonylpyrrolidin-1-ium-1-yl)amino]ethanoyl]pyrrolidine-2-carbonitrile hydrochloride Openeye Name: 4-fluoro-1-[2-[(1-isopropylsulfonylpyrrolidin-1-ium-1-yl)amino]acetyl]pyrrolidine-2-carbonitrile hydrochloride CAS Name: 4-fluoro-1-[1-oxo-2-[(1-propan-2-ylsulfonyl-1-pyrrolidin-1-iumyl)amino]ethyl]-2-pyrrolidinecarbonitrile hydrochloride IUPAC Name: 4-fluoro-1-[2-[(1-propan-2-ylsulfonylpyrrolidin-1-ium-1-yl)amino]acetyl]pyrrolidine-2-carbonitrile hydrochloride Traditional Name: 4-fluoro-1-[2-[(1-isopropylsulfonylpyrrolidin-1-ium-1-yl)amino]acetyl]pyrrolidine-2-carbonitrile hydrochloride Formula: C14H25ClFN4O3S+ MolecularWeight: 383.889703

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)[N+]1(CCCC1)NCC(=O)N2CC(CC2C#N)F.Cl

Isomeric SMILES

CC(C)S(=O)(=O)[N+]1(CCCC1)NCC(=O)N2CC(CC2C#N)F.Cl

InChI

InChI=1S/C14H24FN4O3S.ClH/c1-11(2)23(21,22)19(5-3-4-6-19)17-9-14(20)18-10-12(15)7-13(18)8-16;/h11-13,17H,3-7,9-10H2,1-2H3;1H/q+1;