ethyl 2-[[3-[(4-bromanyl-2-fluoranyl-phenyl)methylcarbamoyl]-5-chloranyl-thiophen-2-yl]amino]ethanoate

Systemtic Name: ethyl 2-[[3-[(4-bromanyl-2-fluoranyl-phenyl)methylcarbamoyl]-5-chloranyl-thiophen-2-yl]amino]ethanoate Openeye Name: ethyl 2-[[3-[(4-bromo-2-fluoro-phenyl)methylcarbamoyl]-5-chloro-2-thienyl]amino]acetate CAS Name: 2-[[3-[[(4-bromo-2-fluorophenyl)methylamino]-oxomethyl]-5-chloro-2-thiophenyl]amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[[3-[(4-bromo-2-fluorophenyl)methylcarbamoyl]-5-chlorothiophen-2-yl]amino]acetate Traditional Name: 2-[[3-[(4-bromo-2-fluoro-benzyl)carbamoyl]-5-chloro-2-thienyl]amino]acetic acid ethyl ester Formula: C16H15BrClFN2O3S MolecularWeight: 449.722303

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CNC1=C(C=C(S1)Cl)C(=O)NCC2=C(C=C(C=C2)Br)F

Isomeric SMILES

CCOC(=O)CNC1=C(C=C(S1)Cl)C(=O)NCC2=C(C=C(C=C2)Br)F

InChI

InChI=1S/C16H15BrClFN2O3S/c1-2-24-14(22)8-21-16-11(6-13(18)25-16)15(23)20-7-9-3-4-10(17)5-12(9)19/h3-6,21H,2,7-8H2,1H3,(H,20,23)