1,3-benzothiazol-2-ylmethyl 3-[(4-ethoxyphenyl)sulfamoyl]-4-methyl-benzoate

Systemtic Name: 1,3-benzothiazol-2-ylmethyl 3-[(4-ethoxyphenyl)sulfamoyl]-4-methyl-benzoate Openeye Name: 1,3-benzothiazol-2-ylmethyl 3-[(4-ethoxyphenyl)sulfamoyl]-4-methyl-benzoate CAS Name: 3-[(4-ethoxyphenyl)sulfamoyl]-4-methylbenzoic acid 1,3-benzothiazol-2-ylmethyl ester IUPAC Name: 1,3-benzothiazol-2-ylmethyl 3-[(4-ethoxyphenyl)sulfamoyl]-4-methylbenzoate Traditional Name: 4-methyl-3-(p-phenetylsulfamoyl)benzoic acid 1,3-benzothiazol-2-ylmethyl ester Formula: C24H22N2O5S2 MolecularWeight: 482.57188

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NS(=O)(=O)C2=C(C=CC(=C2)C(=O)OCC3=NC4=CC=CC=C4S3)C

Isomeric SMILES

CCOC1=CC=C(C=C1)NS(=O)(=O)C2=C(C=CC(=C2)C(=O)OCC3=NC4=CC=CC=C4S3)C

InChI

InChI=1S/C24H22N2O5S2/c1-3-30-19-12-10-18(11-13-19)26-33(28,29)22-14-17(9-8-16(22)2)24(27)31-15-23-25-20-6-4-5-7-21(20)32-23/h4-14,26H,3,15H2,1-2H3