1-[2-[2-(2-bromoethyloxy)-5-methoxy-phenyl]-6-chloranyl-2H-1,3-benzothiazol-3-yl]ethanone

Systemtic Name: 1-[2-[2-(2-bromoethyloxy)-5-methoxy-phenyl]-6-chloranyl-2H-1,3-benzothiazol-3-yl]ethanone Openeye Name: 1-[2-[2-(2-bromoethoxy)-5-methoxy-phenyl]-6-chloro-2H-1,3-benzothiazol-3-yl]ethanone CAS Name: 1-[2-[2-(2-bromoethoxy)-5-methoxyphenyl]-6-chloro-2H-1,3-benzothiazol-3-yl]ethanone IUPAC Name: 1-[2-[2-(2-bromoethoxy)-5-methoxyphenyl]-6-chloro-2H-1,3-benzothiazol-3-yl]ethanone Traditional Name: 1-[2-[2-(2-bromoethoxy)-5-methoxy-phenyl]-6-chloro-2H-1,3-benzothiazol-3-yl]ethanone Formula: C18H17BrClNO3S MolecularWeight: 442.75448

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C(SC2=C1C=CC(=C2)Cl)C3=C(C=CC(=C3)OC)OCCBr

Isomeric SMILES

CC(=O)N1C(SC2=C1C=CC(=C2)Cl)C3=C(C=CC(=C3)OC)OCCBr

InChI

InChI=1S/C18H17BrClNO3S/c1-11(22)21-15-5-3-12(20)9-17(15)25-18(21)14-10-13(23-2)4-6-16(14)24-8-7-19/h3-6,9-10,18H,7-8H2,1-2H3