2-[(4-bromanyl-2-methyl-phenyl)amino]-3,4-bis(fluoranyl)-N-(2-pyrrolidin-1-ylethyl)benzamide

Systemtic Name: 2-[(4-bromanyl-2-methyl-phenyl)amino]-3,4-bis(fluoranyl)-N-(2-pyrrolidin-1-ylethyl)benzamide Openeye Name: 2-(4-bromo-2-methyl-anilino)-3,4-difluoro-N-(2-pyrrolidin-1-ylethyl)benzamide CAS Name: 2-(4-bromo-2-methylanilino)-3,4-difluoro-N-[2-(1-pyrrolidinyl)ethyl]benzamide IUPAC Name: 2-(4-bromo-2-methylanilino)-3,4-difluoro-N-(2-pyrrolidin-1-ylethyl)benzamide Traditional Name: 2-(4-bromo-2-methyl-anilino)-3,4-difluoro-N-(2-pyrrolidinoethyl)benzamide Formula: C20H22BrF2N3O MolecularWeight: 438.308986

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC2=C(C=CC(=C2F)F)C(=O)NCCN3CCCC3

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC2=C(C=CC(=C2F)F)C(=O)NCCN3CCCC3

InChI

InChI=1S/C20H22BrF2N3O/c1-13-12-14(21)4-7-17(13)25-19-15(5-6-16(22)18(19)23)20(27)24-8-11-26-9-2-3-10-26/h4-7,12,25H,2-3,8-11H2,1H3,(H,24,27)