5-fluoranyl-3-[1-[4-(2-methylbutan-2-yl)phenyl]sulfonylpiperidin-4-yl]-1H-indole

Systemtic Name: 5-fluoranyl-3-[1-[4-(2-methylbutan-2-yl)phenyl]sulfonylpiperidin-4-yl]-1H-indole Openeye Name: 3-[1-[4-(1,1-dimethylpropyl)phenyl]sulfonyl-4-piperidyl]-5-fluoro-1H-indole CAS Name: 5-fluoro-3-[1-[4-(2-methylbutan-2-yl)phenyl]sulfonyl-4-piperidinyl]-1H-indole IUPAC Name: 5-fluoro-3-[1-[4-(2-methylbutan-2-yl)phenyl]sulfonylpiperidin-4-yl]-1H-indole Traditional Name: 3-[1-(4-tert-amylphenyl)sulfonyl-4-piperidyl]-5-fluoro-1H-indole Formula: C24H29FN2O2S MolecularWeight: 428.562663

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C3=CNC4=C3C=C(C=C4)F

Isomeric SMILES

CCC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C3=CNC4=C3C=C(C=C4)F

InChI

InChI=1S/C24H29FN2O2S/c1-4-24(2,3)18-5-8-20(9-6-18)30(28,29)27-13-11-17(12-14-27)22-16-26-23-10-7-19(25)15-21(22)23/h5-10,15-17,26H,4,11-14H2,1-3H3