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

Systemtic Name: 2-[(Z)-1-(1,3-benzothiazol-2-yl)-2-(3-methylphenyl)ethenyl]sulfanylethanoate Openeye Name: 2-[(Z)-1-(1,3-benzothiazol-2-yl)-2-(m-tolyl)vinyl]sulfanylacetate CAS Name: 2-[[(Z)-1-(1,3-benzothiazol-2-yl)-2-(3-methylphenyl)ethenyl]thio]acetate IUPAC Name: 2-[(Z)-1-(1,3-benzothiazol-2-yl)-2-(3-methylphenyl)ethenyl]sulfanylacetate Traditional Name: 2-[[(Z)-1-(1,3-benzothiazol-2-yl)-2-(m-tolyl)vinyl]thio]acetate Formula: C18H14NO2S2- MolecularWeight: 340.43926

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H15NO2S2/c1-12-5-4-6-13(9-12)10-16(22-11-17(20)21)18-19-14-7-2-3-8-15(14)23-18/h2-10H,11H2,1H3,(H,20,21)/p-1/b16-10-