2-[(Z)-1-(1,3-benzothiazol-2-yl)-2-(4-methoxy-3-methyl-phenyl)ethenyl]sulfanylethanoic acid

Systemtic Name: 2-[(Z)-1-(1,3-benzothiazol-2-yl)-2-(4-methoxy-3-methyl-phenyl)ethenyl]sulfanylethanoic acid Openeye Name: 2-[(Z)-1-(1,3-benzothiazol-2-yl)-2-(4-methoxy-3-methyl-phenyl)vinyl]sulfanylacetic acid CAS Name: 2-[[(Z)-1-(1,3-benzothiazol-2-yl)-2-(4-methoxy-3-methylphenyl)ethenyl]thio]acetic acid IUPAC Name: 2-[(Z)-1-(1,3-benzothiazol-2-yl)-2-(4-methoxy-3-methylphenyl)ethenyl]sulfanylacetic acid Traditional Name: 2-[[(Z)-1-(1,3-benzothiazol-2-yl)-2-(4-methoxy-3-methyl-phenyl)vinyl]thio]acetic acid Formula: C19H17NO3S2 MolecularWeight: 371.47318

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H17NO3S2/c1-12-9-13(7-8-15(12)23-2)10-17(24-11-18(21)22)19-20-14-5-3-4-6-16(14)25-19/h3-10H,11H2,1-2H3,(H,21,22)/b17-10-