N-[4-[2-[(4-bromanyl-2-fluoranyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanylphenyl]naphthalene-2-carboxamide

Systemtic Name: N-[4-[2-[(4-bromanyl-2-fluoranyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanylphenyl]naphthalene-2-carboxamide Openeye Name: N-[4-[2-(4-bromo-2-fluoro-anilino)-2-oxo-ethyl]sulfanylphenyl]naphthalene-2-carboxamide CAS Name: N-[4-[[2-(4-bromo-2-fluoroanilino)-2-oxoethyl]thio]phenyl]-2-naphthalenecarboxamide IUPAC Name: N-[4-[2-(4-bromo-2-fluoroanilino)-2-oxoethyl]sulfanylphenyl]naphthalene-2-carboxamide Traditional Name: N-[4-[[2-(4-bromo-2-fluoro-anilino)-2-keto-ethyl]thio]phenyl]-2-naphthamide Formula: C25H18BrFN2O2S MolecularWeight: 509.390023

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)C(=O)NC3=CC=C(C=C3)SCC(=O)NC4=C(C=C(C=C4)Br)F

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)C(=O)NC3=CC=C(C=C3)SCC(=O)NC4=C(C=C(C=C4)Br)F

InChI

InChI=1S/C25H18BrFN2O2S/c26-19-7-12-23(22(27)14-19)29-24(30)15-32-21-10-8-20(9-11-21)28-25(31)18-6-5-16-3-1-2-4-17(16)13-18/h1-14H,15H2,(H,28,31)(H,29,30)