3-[3,4-bis(fluoranyl)phenyl]sulfanyl-N-(4-bromanyl-2-methyl-phenyl)propanamide

Systemtic Name: 3-[3,4-bis(fluoranyl)phenyl]sulfanyl-N-(4-bromanyl-2-methyl-phenyl)propanamide Openeye Name: N-(4-bromo-2-methyl-phenyl)-3-(3,4-difluorophenyl)sulfanyl-propanamide CAS Name: N-(4-bromo-2-methylphenyl)-3-[(3,4-difluorophenyl)thio]propanamide IUPAC Name: N-(4-bromo-2-methylphenyl)-3-(3,4-difluorophenyl)sulfanylpropanamide Traditional Name: N-(4-bromo-2-methyl-phenyl)-3-[(3,4-difluorophenyl)thio]propionamide Formula: C16H14BrF2NOS MolecularWeight: 386.254266

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)CCSC2=CC(=C(C=C2)F)F

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)CCSC2=CC(=C(C=C2)F)F

InChI

InChI=1S/C16H14BrF2NOS/c1-10-8-11(17)2-5-15(10)20-16(21)6-7-22-12-3-4-13(18)14(19)9-12/h2-5,8-9H,6-7H2,1H3,(H,20,21)