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

Systemtic Name: 2-[(Z)-1-(1,3-benzothiazol-2-yl)-2-(2,4-dimethylphenyl)ethenyl]sulfanylethanoate Openeye Name: 2-[(Z)-1-(1,3-benzothiazol-2-yl)-2-(2,4-dimethylphenyl)vinyl]sulfanylacetate CAS Name: 2-[[(Z)-1-(1,3-benzothiazol-2-yl)-2-(2,4-dimethylphenyl)ethenyl]thio]acetate IUPAC Name: 2-[(Z)-1-(1,3-benzothiazol-2-yl)-2-(2,4-dimethylphenyl)ethenyl]sulfanylacetate Traditional Name: 2-[[(Z)-1-(1,3-benzothiazol-2-yl)-2-(2,4-dimethylphenyl)vinyl]thio]acetate Formula: C19H16NO2S2- MolecularWeight: 354.46584

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C=C(C2=NC3=CC=CC=C3S2)SCC(=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C=C1)/C=C(/C2=NC3=CC=CC=C3S2)\SCC(=O)[O-])C

InChI

InChI=1S/C19H17NO2S2/c1-12-7-8-14(13(2)9-12)10-17(23-11-18(21)22)19-20-15-5-3-4-6-16(15)24-19/h3-10H,11H2,1-2H3,(H,21,22)/p-1/b17-10-