1,3-benzothiazol-2-ylmethyl 2-(1,3-thiazol-4-ylmethylsulfanyl)benzoate

Systemtic Name: 1,3-benzothiazol-2-ylmethyl 2-(1,3-thiazol-4-ylmethylsulfanyl)benzoate Openeye Name: 1,3-benzothiazol-2-ylmethyl 2-(thiazol-4-ylmethylsulfanyl)benzoate CAS Name: 2-(4-thiazolylmethylthio)benzoic acid 1,3-benzothiazol-2-ylmethyl ester IUPAC Name: 1,3-benzothiazol-2-ylmethyl 2-(1,3-thiazol-4-ylmethylsulfanyl)benzoate Traditional Name: 2-(thiazol-4-ylmethylthio)benzoic acid 1,3-benzothiazol-2-ylmethyl ester Formula: C19H14N2O2S3 MolecularWeight: 398.52166

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)OCC2=NC3=CC=CC=C3S2)SCC4=CSC=N4

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)OCC2=NC3=CC=CC=C3S2)SCC4=CSC=N4

InChI

InChI=1S/C19H14N2O2S3/c22-19(23-9-18-21-15-6-2-4-8-17(15)26-18)14-5-1-3-7-16(14)25-11-13-10-24-12-20-13/h1-8,10,12H,9,11H2