N-[3-(4-cyano-3-fluoranyl-phenyl)-1-[(2S)-1-methoxypropan-2-yl]indol-6-yl]methanesulfonamide

Systemtic Name: N-[3-(4-cyano-3-fluoranyl-phenyl)-1-[(2S)-1-methoxypropan-2-yl]indol-6-yl]methanesulfonamide Openeye Name: N-[3-(4-cyano-3-fluoro-phenyl)-1-[(1S)-2-methoxy-1-methyl-ethyl]indol-6-yl]methanesulfonamide CAS Name: N-[3-(4-cyano-3-fluorophenyl)-1-[(2S)-1-methoxypropan-2-yl]-6-indolyl]methanesulfonamide IUPAC Name: N-[3-(4-cyano-3-fluorophenyl)-1-[(2S)-1-methoxypropan-2-yl]indol-6-yl]methanesulfonamide Traditional Name: N-[3-(4-cyano-3-fluoro-phenyl)-1-[(1S)-2-methoxy-1-methyl-ethyl]indol-6-yl]methanesulfonamide Formula: C20H20FN3O3S MolecularWeight: 401.454503

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC)N1C=C(C2=C1C=C(C=C2)NS(=O)(=O)C)C3=CC(=C(C=C3)C#N)F

Isomeric SMILES

C[C@@H](COC)N1C=C(C2=C1C=C(C=C2)NS(=O)(=O)C)C3=CC(=C(C=C3)C#N)F

InChI

InChI=1S/C20H20FN3O3S/c1-13(12-27-2)24-11-18(14-4-5-15(10-22)19(21)8-14)17-7-6-16(9-20(17)24)23-28(3,25)26/h4-9,11,13,23H,12H2,1-3H3/t13-/m0/s1