2-[4-[(E)-2-(1,3-benzothiazol-2-yl)ethenyl]-2-bromanyl-6-ethoxy-phenoxy]-N,N-dimethyl-ethanamide

Systemtic Name: 2-[4-[(E)-2-(1,3-benzothiazol-2-yl)ethenyl]-2-bromanyl-6-ethoxy-phenoxy]-N,N-dimethyl-ethanamide Openeye Name: 2-[4-[(E)-2-(1,3-benzothiazol-2-yl)vinyl]-2-bromo-6-ethoxy-phenoxy]-N,N-dimethyl-acetamide CAS Name: 2-[4-[(E)-2-(1,3-benzothiazol-2-yl)ethenyl]-2-bromo-6-ethoxyphenoxy]-N,N-dimethylacetamide IUPAC Name: 2-[4-[(E)-2-(1,3-benzothiazol-2-yl)ethenyl]-2-bromo-6-ethoxyphenoxy]-N,N-dimethylacetamide Traditional Name: 2-[4-[(E)-2-(1,3-benzothiazol-2-yl)vinyl]-2-bromo-6-ethoxy-phenoxy]-N,N-dimethyl-acetamide Formula: C21H21BrN2O3S MolecularWeight: 461.37204

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=CC2=NC3=CC=CC=C3S2)Br)OCC(=O)N(C)C

Isomeric SMILES

CCOC1=C(C(=CC(=C1)/C=C/C2=NC3=CC=CC=C3S2)Br)OCC(=O)N(C)C

InChI

InChI=1S/C21H21BrN2O3S/c1-4-26-17-12-14(11-15(22)21(17)27-13-20(25)24(2)3)9-10-19-23-16-7-5-6-8-18(16)28-19/h5-12H,4,13H2,1-3H3/b10-9+