(4,5-dimethoxy-2-methyl-phenyl)methyl 2-(1,3-benzothiazol-2-ylsulfanyl)ethanoate

Systemtic Name: (4,5-dimethoxy-2-methyl-phenyl)methyl 2-(1,3-benzothiazol-2-ylsulfanyl)ethanoate Openeye Name: (4,5-dimethoxy-2-methyl-phenyl)methyl 2-(1,3-benzothiazol-2-ylsulfanyl)acetate CAS Name: 2-(1,3-benzothiazol-2-ylthio)acetic acid (4,5-dimethoxy-2-methylphenyl)methyl ester IUPAC Name: (4,5-dimethoxy-2-methylphenyl)methyl 2-(1,3-benzothiazol-2-ylsulfanyl)acetate Traditional Name: 2-(1,3-benzothiazol-2-ylthio)acetic acid (4,5-dimethoxy-2-methyl-benzyl) ester Formula: C19H19NO4S2 MolecularWeight: 389.48846

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1COC(=O)CSC2=NC3=CC=CC=C3S2)OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1COC(=O)CSC2=NC3=CC=CC=C3S2)OC)OC

InChI

InChI=1S/C19H19NO4S2/c1-12-8-15(22-2)16(23-3)9-13(12)10-24-18(21)11-25-19-20-14-6-4-5-7-17(14)26-19/h4-9H,10-11H2,1-3H3