2-[(Z)-1-(1,3-benzothiazol-2-yl)-2-(3-methoxy-4-prop-2-enoxy-phenyl)ethenyl]sulfanylethanoate

Systemtic Name: 2-[(Z)-1-(1,3-benzothiazol-2-yl)-2-(3-methoxy-4-prop-2-enoxy-phenyl)ethenyl]sulfanylethanoate Openeye Name: 2-[(Z)-2-(4-allyloxy-3-methoxy-phenyl)-1-(1,3-benzothiazol-2-yl)vinyl]sulfanylacetate CAS Name: 2-[[(Z)-1-(1,3-benzothiazol-2-yl)-2-(3-methoxy-4-prop-2-enoxyphenyl)ethenyl]thio]acetate IUPAC Name: 2-[(Z)-1-(1,3-benzothiazol-2-yl)-2-(3-methoxy-4-prop-2-enoxyphenyl)ethenyl]sulfanylacetate Traditional Name: 2-[[(Z)-2-(4-allyloxy-3-methoxy-phenyl)-1-(1,3-benzothiazol-2-yl)vinyl]thio]acetate Formula: C21H18NO4S2- MolecularWeight: 412.50192

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=C(C2=NC3=CC=CC=C3S2)SCC(=O)[O-])OCC=C

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C(/C2=NC3=CC=CC=C3S2)\SCC(=O)[O-])OCC=C

InChI

InChI=1S/C21H19NO4S2/c1-3-10-26-16-9-8-14(11-17(16)25-2)12-19(27-13-20(23)24)21-22-15-6-4-5-7-18(15)28-21/h3-9,11-12H,1,10,13H2,2H3,(H,23,24)/p-1/b19-12-