methyl 2-[(6-chloranyl-1,3-benzothiazol-2-yl)sulfanyl]benzoate

Systemtic Name: methyl 2-[(6-chloranyl-1,3-benzothiazol-2-yl)sulfanyl]benzoate Openeye Name: methyl 2-[(6-chloro-1,3-benzothiazol-2-yl)sulfanyl]benzoate CAS Name: 2-[(6-chloro-1,3-benzothiazol-2-yl)thio]benzoic acid methyl ester IUPAC Name: methyl 2-[(6-chloro-1,3-benzothiazol-2-yl)sulfanyl]benzoate Traditional Name: 2-[(6-chloro-1,3-benzothiazol-2-yl)thio]benzoic acid methyl ester Formula: C15H10ClNO2S2 MolecularWeight: 335.8284

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1SC2=NC3=C(S2)C=C(C=C3)Cl

Isomeric SMILES

COC(=O)C1=CC=CC=C1SC2=NC3=C(S2)C=C(C=C3)Cl

InChI

InChI=1S/C15H10ClNO2S2/c1-19-14(18)10-4-2-3-5-12(10)20-15-17-11-7-6-9(16)8-13(11)21-15/h2-8H,1H3