2-[(Z)-1-(1,3-benzothiazol-2-yl)-2-(4-propoxyphenyl)ethenyl]sulfanylethanoate

Systemtic Name: 2-[(Z)-1-(1,3-benzothiazol-2-yl)-2-(4-propoxyphenyl)ethenyl]sulfanylethanoate Openeye Name: 2-[(Z)-1-(1,3-benzothiazol-2-yl)-2-(4-propoxyphenyl)vinyl]sulfanylacetate CAS Name: 2-[[(Z)-1-(1,3-benzothiazol-2-yl)-2-(4-propoxyphenyl)ethenyl]thio]acetate IUPAC Name: 2-[(Z)-1-(1,3-benzothiazol-2-yl)-2-(4-propoxyphenyl)ethenyl]sulfanylacetate Traditional Name: 2-[[(Z)-1-(1,3-benzothiazol-2-yl)-2-(4-propoxyphenyl)vinyl]thio]acetate Formula: C20H18NO3S2- MolecularWeight: 384.49182

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C=C(C2=NC3=CC=CC=C3S2)SCC(=O)[O-]

Isomeric SMILES

CCCOC1=CC=C(C=C1)/C=C(/C2=NC3=CC=CC=C3S2)\SCC(=O)[O-]

InChI

InChI=1S/C20H19NO3S2/c1-2-11-24-15-9-7-14(8-10-15)12-18(25-13-19(22)23)20-21-16-5-3-4-6-17(16)26-20/h3-10,12H,2,11,13H2,1H3,(H,22,23)/p-1/b18-12-