2-(phenylmethylsulfanyl)-N-(6-sulfamoyl-1,3-benzothiazol-2-yl)ethanamide

Systemtic Name: 2-(phenylmethylsulfanyl)-N-(6-sulfamoyl-1,3-benzothiazol-2-yl)ethanamide Openeye Name: 2-benzylsulfanyl-N-(6-sulfamoyl-1,3-benzothiazol-2-yl)acetamide CAS Name: 2-(phenylmethylthio)-N-(6-sulfamoyl-1,3-benzothiazol-2-yl)acetamide IUPAC Name: 2-benzylsulfanyl-N-(6-sulfamoyl-1,3-benzothiazol-2-yl)acetamide Traditional Name: 2-(benzylthio)-N-(6-sulfamoyl-1,3-benzothiazol-2-yl)acetamide Formula: C16H15N3O3S3 MolecularWeight: 393.5036

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15N3O3S3/c17-25(21,22)12-6-7-13-14(8-12)24-16(18-13)19-15(20)10-23-9-11-4-2-1-3-5-11/h1-8H,9-10H2,(H2,17,21,22)(H,18,19,20)