1,3-benzothiazol-2-ylmethyl 2-(1,3-benzothiazol-2-yl)benzoate

Systemtic Name: 1,3-benzothiazol-2-ylmethyl 2-(1,3-benzothiazol-2-yl)benzoate Openeye Name: 1,3-benzothiazol-2-ylmethyl 2-(1,3-benzothiazol-2-yl)benzoate CAS Name: 2-(1,3-benzothiazol-2-yl)benzoic acid 1,3-benzothiazol-2-ylmethyl ester IUPAC Name: 1,3-benzothiazol-2-ylmethyl 2-(1,3-benzothiazol-2-yl)benzoate Traditional Name: 2-(1,3-benzothiazol-2-yl)benzoic acid 1,3-benzothiazol-2-ylmethyl ester Formula: C22H14N2O2S2 MolecularWeight: 402.48876

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=NC3=CC=CC=C3S2)C(=O)OCC4=NC5=CC=CC=C5S4

Isomeric SMILES

C1=CC=C(C(=C1)C2=NC3=CC=CC=C3S2)C(=O)OCC4=NC5=CC=CC=C5S4

InChI

InChI=1S/C22H14N2O2S2/c25-22(26-13-20-23-16-9-3-5-11-18(16)27-20)15-8-2-1-7-14(15)21-24-17-10-4-6-12-19(17)28-21/h1-12H,13H2