1,3-benzothiazol-2-ylmethyl 2-oxidanyl-5-(thiophen-2-ylsulfonylamino)benzoate

Systemtic Name: 1,3-benzothiazol-2-ylmethyl 2-oxidanyl-5-(thiophen-2-ylsulfonylamino)benzoate Openeye Name: 1,3-benzothiazol-2-ylmethyl 2-hydroxy-5-(2-thienylsulfonylamino)benzoate CAS Name: 2-hydroxy-5-(thiophen-2-ylsulfonylamino)benzoic acid 1,3-benzothiazol-2-ylmethyl ester IUPAC Name: 1,3-benzothiazol-2-ylmethyl 2-hydroxy-5-(thiophen-2-ylsulfonylamino)benzoate Traditional Name: 2-hydroxy-5-(2-thienylsulfonylamino)benzoic acid 1,3-benzothiazol-2-ylmethyl ester Formula: C19H14N2O5S3 MolecularWeight: 446.51986

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)COC(=O)C3=C(C=CC(=C3)NS(=O)(=O)C4=CC=CS4)O

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)COC(=O)C3=C(C=CC(=C3)NS(=O)(=O)C4=CC=CS4)O

InChI

InChI=1S/C19H14N2O5S3/c22-15-8-7-12(21-29(24,25)18-6-3-9-27-18)10-13(15)19(23)26-11-17-20-14-4-1-2-5-16(14)28-17/h1-10,21-22H,11H2