N-[2-(2-bromanyl-4,5-dimethoxy-phenyl)ethyl]-3-methyl-1-benzothiophene-2-carboxamide

Systemtic Name: N-[2-(2-bromanyl-4,5-dimethoxy-phenyl)ethyl]-3-methyl-1-benzothiophene-2-carboxamide Openeye Name: N-[2-(2-bromo-4,5-dimethoxy-phenyl)ethyl]-3-methyl-benzothiophene-2-carboxamide CAS Name: N-[2-(2-bromo-4,5-dimethoxyphenyl)ethyl]-3-methyl-1-benzothiophene-2-carboxamide IUPAC Name: N-[2-(2-bromo-4,5-dimethoxyphenyl)ethyl]-3-methyl-1-benzothiophene-2-carboxamide Traditional Name: N-[2-(2-bromo-4,5-dimethoxy-phenyl)ethyl]-3-methyl-benzothiophene-2-carboxamide Formula: C20H20BrNO3S MolecularWeight: 434.3467

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=CC=CC=C12)C(=O)NCCC3=CC(=C(C=C3Br)OC)OC

Isomeric SMILES

CC1=C(SC2=CC=CC=C12)C(=O)NCCC3=CC(=C(C=C3Br)OC)OC

InChI

InChI=1S/C20H20BrNO3S/c1-12-14-6-4-5-7-18(14)26-19(12)20(23)22-9-8-13-10-16(24-2)17(25-3)11-15(13)21/h4-7,10-11H,8-9H2,1-3H3,(H,22,23)