2-(1,3-benzothiazol-2-ylsulfanyl)-N-[2-(2-bromanyl-4,5-dimethoxy-phenyl)ethyl]ethanamide

Systemtic Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[2-(2-bromanyl-4,5-dimethoxy-phenyl)ethyl]ethanamide Openeye Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[2-(2-bromo-4,5-dimethoxy-phenyl)ethyl]acetamide CAS Name: 2-(1,3-benzothiazol-2-ylthio)-N-[2-(2-bromo-4,5-dimethoxyphenyl)ethyl]acetamide IUPAC Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[2-(2-bromo-4,5-dimethoxyphenyl)ethyl]acetamide Traditional Name: 2-(1,3-benzothiazol-2-ylthio)-N-[2-(2-bromo-4,5-dimethoxy-phenyl)ethyl]acetamide Formula: C19H19BrN2O3S2 MolecularWeight: 467.39976

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)CCNC(=O)CSC2=NC3=CC=CC=C3S2)Br)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)CCNC(=O)CSC2=NC3=CC=CC=C3S2)Br)OC

InChI

InChI=1S/C19H19BrN2O3S2/c1-24-15-9-12(13(20)10-16(15)25-2)7-8-21-18(23)11-26-19-22-14-5-3-4-6-17(14)27-19/h3-6,9-10H,7-8,11H2,1-2H3,(H,21,23)