1,3-benzothiazol-2-ylmethyl 5-(furan-2-ylmethylsulfamoyl)-2-methyl-benzoate

Systemtic Name: 1,3-benzothiazol-2-ylmethyl 5-(furan-2-ylmethylsulfamoyl)-2-methyl-benzoate Openeye Name: 1,3-benzothiazol-2-ylmethyl 5-(2-furylmethylsulfamoyl)-2-methyl-benzoate CAS Name: 5-(2-furanylmethylsulfamoyl)-2-methylbenzoic acid 1,3-benzothiazol-2-ylmethyl ester IUPAC Name: 1,3-benzothiazol-2-ylmethyl 5-(furan-2-ylmethylsulfamoyl)-2-methylbenzoate Traditional Name: 5-(2-furfurylsulfamoyl)-2-methyl-benzoic acid 1,3-benzothiazol-2-ylmethyl ester Formula: C21H18N2O5S2 MolecularWeight: 442.50802

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NCC2=CC=CO2)C(=O)OCC3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NCC2=CC=CO2)C(=O)OCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H18N2O5S2/c1-14-8-9-16(30(25,26)22-12-15-5-4-10-27-15)11-17(14)21(24)28-13-20-23-18-6-2-3-7-19(18)29-20/h2-11,22H,12-13H2,1H3