N-[2-(2-bromanyl-4,5-dimethoxy-phenyl)ethyl]-4-phenylsulfanyl-butanamide

Systemtic Name: N-[2-(2-bromanyl-4,5-dimethoxy-phenyl)ethyl]-4-phenylsulfanyl-butanamide Openeye Name: N-[2-(2-bromo-4,5-dimethoxy-phenyl)ethyl]-4-phenylsulfanyl-butanamide CAS Name: N-[2-(2-bromo-4,5-dimethoxyphenyl)ethyl]-4-(phenylthio)butanamide IUPAC Name: N-[2-(2-bromo-4,5-dimethoxyphenyl)ethyl]-4-phenylsulfanylbutanamide Traditional Name: N-[2-(2-bromo-4,5-dimethoxy-phenyl)ethyl]-4-(phenylthio)butyramide Formula: C20H24BrNO3S MolecularWeight: 438.37846

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)CCNC(=O)CCCSC2=CC=CC=C2)Br)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)CCNC(=O)CCCSC2=CC=CC=C2)Br)OC

InChI

InChI=1S/C20H24BrNO3S/c1-24-18-13-15(17(21)14-19(18)25-2)10-11-22-20(23)9-6-12-26-16-7-4-3-5-8-16/h3-5,7-8,13-14H,6,9-12H2,1-2H3,(H,22,23)