5-bromanyl-3,4-bis(fluoranyl)-2-[(4-iodanyl-2-methyl-phenyl)amino]-N-(2-pyridin-4-ylethyl)benzamide

Systemtic Name: 5-bromanyl-3,4-bis(fluoranyl)-2-[(4-iodanyl-2-methyl-phenyl)amino]-N-(2-pyridin-4-ylethyl)benzamide Openeye Name: 5-bromo-3,4-difluoro-2-(4-iodo-2-methyl-anilino)-N-[2-(4-pyridyl)ethyl]benzamide CAS Name: 5-bromo-3,4-difluoro-2-(4-iodo-2-methylanilino)-N-(2-pyridin-4-ylethyl)benzamide IUPAC Name: 5-bromo-3,4-difluoro-2-(4-iodo-2-methylanilino)-N-(2-pyridin-4-ylethyl)benzamide Traditional Name: 5-bromo-3,4-difluoro-2-(4-iodo-2-methyl-anilino)-N-[2-(4-pyridyl)ethyl]benzamide Formula: C21H17BrF2IN3O MolecularWeight: 572.184456

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)I)NC2=C(C(=C(C=C2C(=O)NCCC3=CC=NC=C3)Br)F)F

Isomeric SMILES

CC1=C(C=CC(=C1)I)NC2=C(C(=C(C=C2C(=O)NCCC3=CC=NC=C3)Br)F)F

InChI

InChI=1S/C21H17BrF2IN3O/c1-12-10-14(25)2-3-17(12)28-20-15(11-16(22)18(23)19(20)24)21(29)27-9-6-13-4-7-26-8-5-13/h2-5,7-8,10-11,28H,6,9H2,1H3,(H,27,29)