2-[(4-bromanyl-2-fluoranyl-phenyl)-(2-chloranylethanoyl)amino]-N-cyclohexyl-2-pyridin-3-yl-ethanamide

Systemtic Name: 2-[(4-bromanyl-2-fluoranyl-phenyl)-(2-chloranylethanoyl)amino]-N-cyclohexyl-2-pyridin-3-yl-ethanamide Openeye Name: 2-(4-bromo-N-(2-chloroacetyl)-2-fluoro-anilino)-N-cyclohexyl-2-(3-pyridyl)acetamide CAS Name: 2-(4-bromo-N-(2-chloro-1-oxoethyl)-2-fluoroanilino)-N-cyclohexyl-2-(3-pyridinyl)acetamide IUPAC Name: 2-(4-bromo-N-(2-chloroacetyl)-2-fluoroanilino)-N-cyclohexyl-2-pyridin-3-ylacetamide Traditional Name: 2-(4-bromo-N-(2-chloroacetyl)-2-fluoro-anilino)-N-cyclohexyl-2-(3-pyridyl)acetamide Formula: C21H22BrClFN3O2 MolecularWeight: 482.773683

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)C(C2=CN=CC=C2)N(C3=C(C=C(C=C3)Br)F)C(=O)CCl

Isomeric SMILES

C1CCC(CC1)NC(=O)C(C2=CN=CC=C2)N(C3=C(C=C(C=C3)Br)F)C(=O)CCl

InChI

InChI=1S/C21H22BrClFN3O2/c22-15-8-9-18(17(24)11-15)27(19(28)12-23)20(14-5-4-10-25-13-14)21(29)26-16-6-2-1-3-7-16/h4-5,8-11,13,16,20H,1-3,6-7,12H2,(H,26,29)