2-[(E)-2-(3-bromanyl-5-ethoxy-4-prop-2-enoxy-phenyl)ethenyl]-1,3-benzothiazole

Systemtic Name: 2-[(E)-2-(3-bromanyl-5-ethoxy-4-prop-2-enoxy-phenyl)ethenyl]-1,3-benzothiazole Openeye Name: 2-[(E)-2-(4-allyloxy-3-bromo-5-ethoxy-phenyl)vinyl]-1,3-benzothiazole CAS Name: 2-[(E)-2-(3-bromo-5-ethoxy-4-prop-2-enoxyphenyl)ethenyl]-1,3-benzothiazole IUPAC Name: 2-[(E)-2-(3-bromo-5-ethoxy-4-prop-2-enoxyphenyl)ethenyl]-1,3-benzothiazole Traditional Name: 2-[(E)-2-(4-allyloxy-3-bromo-5-ethoxy-phenyl)vinyl]-1,3-benzothiazole Formula: C20H18BrNO2S MolecularWeight: 416.33142

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H18BrNO2S/c1-3-11-24-20-15(21)12-14(13-17(20)23-4-2)9-10-19-22-16-7-5-6-8-18(16)25-19/h3,5-10,12-13H,1,4,11H2,2H3/b10-9+