N-(4-bromanyl-2-fluoranyl-phenyl)-N'-[(E)-[3-(4,5-dihydro-1,3-thiazol-2-ylsulfanylmethyl)-4-methoxy-phenyl]methylideneamino]ethanediamide

Systemtic Name: N-(4-bromanyl-2-fluoranyl-phenyl)-N'-[(E)-[3-(4,5-dihydro-1,3-thiazol-2-ylsulfanylmethyl)-4-methoxy-phenyl]methylideneamino]ethanediamide Openeye Name: N-(4-bromo-2-fluoro-phenyl)-N'-[(E)-[3-(4,5-dihydrothiazol-2-ylsulfanylmethyl)-4-methoxy-phenyl]methyleneamino]oxamide CAS Name: N-(4-bromo-2-fluorophenyl)-N'-[(E)-[3-[(4,5-dihydrothiazol-2-ylthio)methyl]-4-methoxyphenyl]methylideneamino]oxamide IUPAC Name: N-(4-bromo-2-fluorophenyl)-N'-[(E)-[3-(4,5-dihydro-1,3-thiazol-2-ylsulfanylmethyl)-4-methoxyphenyl]methylideneamino]oxamide Traditional Name: N-(4-bromo-2-fluoro-phenyl)-N'-[(E)-[4-methoxy-3-[(2-thiazolin-2-ylthio)methyl]benzylidene]amino]oxamide Formula: C20H18BrFN4O3S2 MolecularWeight: 525.414323

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=NNC(=O)C(=O)NC2=C(C=C(C=C2)Br)F)CSC3=NCCS3

Isomeric SMILES

COC1=C(C=C(C=C1)/C=N/NC(=O)C(=O)NC2=C(C=C(C=C2)Br)F)CSC3=NCCS3

InChI

InChI=1S/C20H18BrFN4O3S2/c1-29-17-5-2-12(8-13(17)11-31-20-23-6-7-30-20)10-24-26-19(28)18(27)25-16-4-3-14(21)9-15(16)22/h2-5,8-10H,6-7,11H2,1H3,(H,25,27)(H,26,28)/b24-10+