2-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]-2-(4-methylphenyl)propanoic acid

Systemtic Name: 2-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]-2-(4-methylphenyl)propanoic acid Openeye Name: 2-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]-2-(p-tolyl)propanoic acid CAS Name: 2-[(6-ethoxy-1,3-benzothiazol-2-yl)thio]-2-(4-methylphenyl)propanoic acid IUPAC Name: 2-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]-2-(4-methylphenyl)propanoic acid Traditional Name: 2-[(6-ethoxy-1,3-benzothiazol-2-yl)thio]-2-(p-tolyl)propionic acid Formula: C19H19NO3S2 MolecularWeight: 373.48906

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)SC(C)(C3=CC=C(C=C3)C)C(=O)O

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)SC(C)(C3=CC=C(C=C3)C)C(=O)O

InChI

InChI=1S/C19H19NO3S2/c1-4-23-14-9-10-15-16(11-14)24-18(20-15)25-19(3,17(21)22)13-7-5-12(2)6-8-13/h5-11H,4H2,1-3H3,(H,21,22)