N-[2-(2-bromanyl-4,5-dimethoxy-phenyl)ethyl]-2-chloranyl-5-methylsulfanyl-benzamide

Systemtic Name: N-[2-(2-bromanyl-4,5-dimethoxy-phenyl)ethyl]-2-chloranyl-5-methylsulfanyl-benzamide Openeye Name: N-[2-(2-bromo-4,5-dimethoxy-phenyl)ethyl]-2-chloro-5-methylsulfanyl-benzamide CAS Name: N-[2-(2-bromo-4,5-dimethoxyphenyl)ethyl]-2-chloro-5-(methylthio)benzamide IUPAC Name: N-[2-(2-bromo-4,5-dimethoxyphenyl)ethyl]-2-chloro-5-methylsulfanylbenzamide Traditional Name: N-[2-(2-bromo-4,5-dimethoxy-phenyl)ethyl]-2-chloro-5-(methylthio)benzamide Formula: C18H19BrClNO3S MolecularWeight: 444.77036

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19BrClNO3S/c1-23-16-8-11(14(19)10-17(16)24-2)6-7-21-18(22)13-9-12(25-3)4-5-15(13)20/h4-5,8-10H,6-7H2,1-3H3,(H,21,22)