2-[(Z)-1-(1,3-benzothiazol-2-yl)-2-(3-methylthiophen-2-yl)ethenyl]sulfanylethanoic acid

Systemtic Name: 2-[(Z)-1-(1,3-benzothiazol-2-yl)-2-(3-methylthiophen-2-yl)ethenyl]sulfanylethanoic acid Openeye Name: 2-[(Z)-1-(1,3-benzothiazol-2-yl)-2-(3-methyl-2-thienyl)vinyl]sulfanylacetic acid CAS Name: 2-[[(Z)-1-(1,3-benzothiazol-2-yl)-2-(3-methyl-2-thiophenyl)ethenyl]thio]acetic acid IUPAC Name: 2-[(Z)-1-(1,3-benzothiazol-2-yl)-2-(3-methylthiophen-2-yl)ethenyl]sulfanylacetic acid Traditional Name: 2-[[(Z)-1-(1,3-benzothiazol-2-yl)-2-(3-methyl-2-thienyl)vinyl]thio]acetic acid Formula: C16H13NO2S3 MolecularWeight: 347.47492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C=C(C2=NC3=CC=CC=C3S2)SCC(=O)O

Isomeric SMILES

CC1=C(SC=C1)/C=C(/C2=NC3=CC=CC=C3S2)\SCC(=O)O

InChI

InChI=1S/C16H13NO2S3/c1-10-6-7-20-13(10)8-14(21-9-15(18)19)16-17-11-4-2-3-5-12(11)22-16/h2-8H,9H2,1H3,(H,18,19)/b14-8-