3-[1-(4-bromanyl-2-ethyl-phenyl)sulfonylpiperidin-4-yl]-5-methyl-1H-indole

Systemtic Name: 3-[1-(4-bromanyl-2-ethyl-phenyl)sulfonylpiperidin-4-yl]-5-methyl-1H-indole Openeye Name: 3-[1-(4-bromo-2-ethyl-phenyl)sulfonyl-4-piperidyl]-5-methyl-1H-indole CAS Name: 3-[1-(4-bromo-2-ethylphenyl)sulfonyl-4-piperidinyl]-5-methyl-1H-indole IUPAC Name: 3-[1-(4-bromo-2-ethylphenyl)sulfonylpiperidin-4-yl]-5-methyl-1H-indole Traditional Name: 3-[1-(4-bromo-2-ethyl-phenyl)sulfonyl-4-piperidyl]-5-methyl-1H-indole Formula: C22H25BrN2O2S MolecularWeight: 461.4151

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)Br)S(=O)(=O)N2CCC(CC2)C3=CNC4=C3C=C(C=C4)C

Isomeric SMILES

CCC1=C(C=CC(=C1)Br)S(=O)(=O)N2CCC(CC2)C3=CNC4=C3C=C(C=C4)C

InChI

InChI=1S/C22H25BrN2O2S/c1-3-16-13-18(23)5-7-22(16)28(26,27)25-10-8-17(9-11-25)20-14-24-21-6-4-15(2)12-19(20)21/h4-7,12-14,17,24H,3,8-11H2,1-2H3