2-[(5-chloranyl-1,3-benzothiazol-2-yl)sulfanyl]-N-[2-(4-sulfamoylphenyl)ethyl]ethanamide

Systemtic Name: 2-[(5-chloranyl-1,3-benzothiazol-2-yl)sulfanyl]-N-[2-(4-sulfamoylphenyl)ethyl]ethanamide Openeye Name: 2-[(5-chloro-1,3-benzothiazol-2-yl)sulfanyl]-N-[2-(4-sulfamoylphenyl)ethyl]acetamide CAS Name: 2-[(5-chloro-1,3-benzothiazol-2-yl)thio]-N-[2-(4-sulfamoylphenyl)ethyl]acetamide IUPAC Name: 2-[(5-chloro-1,3-benzothiazol-2-yl)sulfanyl]-N-[2-(4-sulfamoylphenyl)ethyl]acetamide Traditional Name: 2-[(5-chloro-1,3-benzothiazol-2-yl)thio]-N-[2-(4-sulfamoylphenyl)ethyl]acetamide Formula: C17H16ClN3O3S3 MolecularWeight: 441.97524

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCNC(=O)CSC2=NC3=C(S2)C=CC(=C3)Cl)S(=O)(=O)N

Isomeric SMILES

C1=CC(=CC=C1CCNC(=O)CSC2=NC3=C(S2)C=CC(=C3)Cl)S(=O)(=O)N

InChI

InChI=1S/C17H16ClN3O3S3/c18-12-3-6-15-14(9-12)21-17(26-15)25-10-16(22)20-8-7-11-1-4-13(5-2-11)27(19,23)24/h1-6,9H,7-8,10H2,(H,20,22)(H2,19,23,24)