2-[3-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfonyl]indol-1-yl]-N-(3-methylbutyl)ethanamide

Systemtic Name: 2-[3-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfonyl]indol-1-yl]-N-(3-methylbutyl)ethanamide Openeye Name: 2-[3-[(2-chloro-6-fluoro-phenyl)methylsulfonyl]indol-1-yl]-N-isopentyl-acetamide CAS Name: 2-[3-[(2-chloro-6-fluorophenyl)methylsulfonyl]-1-indolyl]-N-(3-methylbutyl)acetamide IUPAC Name: 2-[3-[(2-chloro-6-fluorophenyl)methylsulfonyl]indol-1-yl]-N-(3-methylbutyl)acetamide Traditional Name: 2-[3-(2-chloro-6-fluoro-benzyl)sulfonylindol-1-yl]-N-isoamyl-acetamide Formula: C22H24ClFN2O3S MolecularWeight: 450.953963

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)CN1C=C(C2=CC=CC=C21)S(=O)(=O)CC3=C(C=CC=C3Cl)F

Isomeric SMILES

CC(C)CCNC(=O)CN1C=C(C2=CC=CC=C21)S(=O)(=O)CC3=C(C=CC=C3Cl)F

InChI

InChI=1S/C22H24ClFN2O3S/c1-15(2)10-11-25-22(27)13-26-12-21(16-6-3-4-9-20(16)26)30(28,29)14-17-18(23)7-5-8-19(17)24/h3-9,12,15H,10-11,13-14H2,1-2H3,(H,25,27)