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

Systemtic Name: 2-[(4-bromanyl-2-methyl-phenyl)amino]-3,4-bis(fluoranyl)-N-(pyridin-4-ylmethyl)benzamide Openeye Name: 2-(4-bromo-2-methyl-anilino)-3,4-difluoro-N-(4-pyridylmethyl)benzamide CAS Name: 2-(4-bromo-2-methylanilino)-3,4-difluoro-N-(pyridin-4-ylmethyl)benzamide IUPAC Name: 2-(4-bromo-2-methylanilino)-3,4-difluoro-N-(pyridin-4-ylmethyl)benzamide Traditional Name: 2-(4-bromo-2-methyl-anilino)-3,4-difluoro-N-(4-pyridylmethyl)benzamide Formula: C20H16BrF2N3O MolecularWeight: 432.261346

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC2=C(C=CC(=C2F)F)C(=O)NCC3=CC=NC=C3

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC2=C(C=CC(=C2F)F)C(=O)NCC3=CC=NC=C3

InChI

InChI=1S/C20H16BrF2N3O/c1-12-10-14(21)2-5-17(12)26-19-15(3-4-16(22)18(19)23)20(27)25-11-13-6-8-24-9-7-13/h2-10,26H,11H2,1H3,(H,25,27)