4-[2-bromanyl-3-(trifluoromethyl)phenyl]-5-(methylamino)-2-phenyl-thiophen-3-one

Systemtic Name: 4-[2-bromanyl-3-(trifluoromethyl)phenyl]-5-(methylamino)-2-phenyl-thiophen-3-one Openeye Name: 4-[2-bromo-3-(trifluoromethyl)phenyl]-5-(methylamino)-2-phenyl-thiophen-3-one CAS Name: 4-[2-bromo-3-(trifluoromethyl)phenyl]-5-(methylamino)-2-phenyl-3-thiophenone IUPAC Name: 4-[2-bromo-3-(trifluoromethyl)phenyl]-5-(methylamino)-2-phenylthiophen-3-one Traditional Name: 4-[2-bromo-3-(trifluoromethyl)phenyl]-5-(methylamino)-2-phenyl-thiophen-3-one Formula: C18H13BrF3NOS MolecularWeight: 428.26613

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C(=O)C(S1)C2=CC=CC=C2)C3=C(C(=CC=C3)C(F)(F)F)Br

Isomeric SMILES

CNC1=C(C(=O)C(S1)C2=CC=CC=C2)C3=C(C(=CC=C3)C(F)(F)F)Br

InChI

InChI=1S/C18H13BrF3NOS/c1-23-17-13(11-8-5-9-12(14(11)19)18(20,21)22)15(24)16(25-17)10-6-3-2-4-7-10/h2-9,16,23H,1H3