N-(4-bromophenyl)-2-(6-tert-butyl-3-cyano-4-phenyl-pyridin-2-yl)sulfinyl-ethanamide

Systemtic Name: N-(4-bromophenyl)-2-(6-tert-butyl-3-cyano-4-phenyl-pyridin-2-yl)sulfinyl-ethanamide Openeye Name: N-(4-bromophenyl)-2-[(6-tert-butyl-3-cyano-4-phenyl-2-pyridyl)sulfinyl]acetamide CAS Name: N-(4-bromophenyl)-2-[(6-tert-butyl-3-cyano-4-phenyl-2-pyridinyl)sulfinyl]acetamide IUPAC Name: N-(4-bromophenyl)-2-(6-tert-butyl-3-cyano-4-phenylpyridin-2-yl)sulfinylacetamide Traditional Name: N-(4-bromophenyl)-2-[(6-tert-butyl-3-cyano-4-phenyl-2-pyridyl)sulfinyl]acetamide Formula: C24H22BrN3O2S MolecularWeight: 496.41938

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC(=C(C(=C1)C2=CC=CC=C2)C#N)S(=O)CC(=O)NC3=CC=C(C=C3)Br

Isomeric SMILES

CC(C)(C)C1=NC(=C(C(=C1)C2=CC=CC=C2)C#N)S(=O)CC(=O)NC3=CC=C(C=C3)Br

InChI

InChI=1S/C24H22BrN3O2S/c1-24(2,3)21-13-19(16-7-5-4-6-8-16)20(14-26)23(28-21)31(30)15-22(29)27-18-11-9-17(25)10-12-18/h4-13H,15H2,1-3H3,(H,27,29)