5-[(4-bromanyl-2-chloranyl-phenoxy)methyl]-N-[3-(4-methylphenyl)sulfanyl-5-nitro-phenyl]furan-2-carboxamide

Systemtic Name: 5-[(4-bromanyl-2-chloranyl-phenoxy)methyl]-N-[3-(4-methylphenyl)sulfanyl-5-nitro-phenyl]furan-2-carboxamide Openeye Name: 5-[(4-bromo-2-chloro-phenoxy)methyl]-N-[3-nitro-5-(p-tolylsulfanyl)phenyl]furan-2-carboxamide CAS Name: 5-[(4-bromo-2-chlorophenoxy)methyl]-N-[3-[(4-methylphenyl)thio]-5-nitrophenyl]-2-furancarboxamide IUPAC Name: 5-[(4-bromo-2-chlorophenoxy)methyl]-N-[3-(4-methylphenyl)sulfanyl-5-nitrophenyl]furan-2-carboxamide Traditional Name: 5-[(4-bromo-2-chloro-phenoxy)methyl]-N-[3-nitro-5-(p-tolylthio)phenyl]-2-furamide Formula: C25H18BrClN2O5S MolecularWeight: 573.84282

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C3=CC=C(O3)COC4=C(C=C(C=C4)Br)Cl

Isomeric SMILES

CC1=CC=C(C=C1)SC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C3=CC=C(O3)COC4=C(C=C(C=C4)Br)Cl

InChI

InChI=1S/C25H18BrClN2O5S/c1-15-2-6-20(7-3-15)35-21-12-17(11-18(13-21)29(31)32)28-25(30)24-9-5-19(34-24)14-33-23-8-4-16(26)10-22(23)27/h2-13H,14H2,1H3,(H,28,30)