3-(phenylsulfonyl)-N-(6-sulfamoyl-1,3-benzothiazol-2-yl)propanamide

Systemtic Name: 3-(phenylsulfonyl)-N-(6-sulfamoyl-1,3-benzothiazol-2-yl)propanamide Openeye Name: 3-(benzenesulfonyl)-N-(6-sulfamoyl-1,3-benzothiazol-2-yl)propanamide CAS Name: 3-(benzenesulfonyl)-N-(6-sulfamoyl-1,3-benzothiazol-2-yl)propanamide IUPAC Name: 3-(benzenesulfonyl)-N-(6-sulfamoyl-1,3-benzothiazol-2-yl)propanamide Traditional Name: 3-besyl-N-(6-sulfamoyl-1,3-benzothiazol-2-yl)propionamide Formula: C16H15N3O5S3 MolecularWeight: 425.5024

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)CCC(=O)NC2=NC3=C(S2)C=C(C=C3)S(=O)(=O)N

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)CCC(=O)NC2=NC3=C(S2)C=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C16H15N3O5S3/c17-27(23,24)12-6-7-13-14(10-12)25-16(18-13)19-15(20)8-9-26(21,22)11-4-2-1-3-5-11/h1-7,10H,8-9H2,(H2,17,23,24)(H,18,19,20)