6-[5-bromanyl-1-(4-methylphenyl)sulfonyl-indol-3-yl]-2-methoxy-4-(trifluoromethyl)pyridine-3-carbonitrile

Systemtic Name: 6-[5-bromanyl-1-(4-methylphenyl)sulfonyl-indol-3-yl]-2-methoxy-4-(trifluoromethyl)pyridine-3-carbonitrile Openeye Name: 6-[5-bromo-1-(p-tolylsulfonyl)indol-3-yl]-2-methoxy-4-(trifluoromethyl)pyridine-3-carbonitrile CAS Name: 6-[5-bromo-1-(4-methylphenyl)sulfonyl-3-indolyl]-2-methoxy-4-(trifluoromethyl)-3-pyridinecarbonitrile IUPAC Name: 6-[5-bromo-1-(4-methylphenyl)sulfonylindol-3-yl]-2-methoxy-4-(trifluoromethyl)pyridine-3-carbonitrile Traditional Name: 6-(5-bromo-1-tosyl-indol-3-yl)-2-methoxy-4-(trifluoromethyl)nicotinonitrile Formula: C23H15BrF3N3O3S MolecularWeight: 550.34771

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=C2C=CC(=C3)Br)C4=NC(=C(C(=C4)C(F)(F)F)C#N)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=C2C=CC(=C3)Br)C4=NC(=C(C(=C4)C(F)(F)F)C#N)OC

InChI

InChI=1S/C23H15BrF3N3O3S/c1-13-3-6-15(7-4-13)34(31,32)30-12-18(16-9-14(24)5-8-21(16)30)20-10-19(23(25,26)27)17(11-28)22(29-20)33-2/h3-10,12H,1-2H3