1,3-benzothiazol-2-ylmethyl 4-morpholin-4-ylsulfonylbenzoate

Systemtic Name: 1,3-benzothiazol-2-ylmethyl 4-morpholin-4-ylsulfonylbenzoate Openeye Name: 1,3-benzothiazol-2-ylmethyl 4-morpholinosulfonylbenzoate CAS Name: 4-(4-morpholinylsulfonyl)benzoic acid 1,3-benzothiazol-2-ylmethyl ester IUPAC Name: 1,3-benzothiazol-2-ylmethyl 4-morpholin-4-ylsulfonylbenzoate Traditional Name: 4-morpholinosulfonylbenzoic acid 1,3-benzothiazol-2-ylmethyl ester Formula: C19H18N2O5S2 MolecularWeight: 418.48662

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)C(=O)OCC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)C(=O)OCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C19H18N2O5S2/c22-19(26-13-18-20-16-3-1-2-4-17(16)27-18)14-5-7-15(8-6-14)28(23,24)21-9-11-25-12-10-21/h1-8H,9-13H2