2-[4-[2-(4-fluorophenyl)pyrrolidin-1-yl]carbonylpiperidin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 2-[4-[2-(4-fluorophenyl)pyrrolidin-1-yl]carbonylpiperidin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 2-[[4-[2-(4-fluorophenyl)pyrrolidine-1-carbonyl]-1-piperidyl]sulfonyl]benzonitrile CAS Name: 2-[[4-[[2-(4-fluorophenyl)-1-pyrrolidinyl]-oxomethyl]-1-piperidinyl]sulfonyl]benzonitrile IUPAC Name: 2-[4-[2-(4-fluorophenyl)pyrrolidine-1-carbonyl]piperidin-1-yl]sulfonylbenzonitrile Traditional Name: 2-[4-[2-(4-fluorophenyl)pyrrolidine-1-carbonyl]piperidino]sulfonylbenzonitrile Formula: C23H24FN3O3S MolecularWeight: 441.518363

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3C#N)C4=CC=C(C=C4)F

Isomeric SMILES

C1CC(N(C1)C(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3C#N)C4=CC=C(C=C4)F

InChI

InChI=1S/C23H24FN3O3S/c24-20-9-7-17(8-10-20)21-5-3-13-27(21)23(28)18-11-14-26(15-12-18)31(29,30)22-6-2-1-4-19(22)16-25/h1-2,4,6-10,18,21H,3,5,11-15H2