2,2,2-tris(chloranyl)-N-(6-pyrrolidin-1-ylsulfonyl-1,3-benzothiazol-2-yl)ethanamide

Systemtic Name: 2,2,2-tris(chloranyl)-N-(6-pyrrolidin-1-ylsulfonyl-1,3-benzothiazol-2-yl)ethanamide Openeye Name: 2,2,2-trichloro-N-(6-pyrrolidin-1-ylsulfonyl-1,3-benzothiazol-2-yl)acetamide CAS Name: 2,2,2-trichloro-N-[6-(1-pyrrolidinylsulfonyl)-1,3-benzothiazol-2-yl]acetamide IUPAC Name: 2,2,2-trichloro-N-(6-pyrrolidin-1-ylsulfonyl-1,3-benzothiazol-2-yl)acetamide Traditional Name: 2,2,2-trichloro-N-(6-pyrrolidinosulfonyl-1,3-benzothiazol-2-yl)acetamide Formula: C13H12Cl3N3O3S2 MolecularWeight: 428.74168

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC3=C(C=C2)N=C(S3)NC(=O)C(Cl)(Cl)Cl

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC3=C(C=C2)N=C(S3)NC(=O)C(Cl)(Cl)Cl

InChI

InChI=1S/C13H12Cl3N3O3S2/c14-13(15,16)11(20)18-12-17-9-4-3-8(7-10(9)23-12)24(21,22)19-5-1-2-6-19/h3-4,7H,1-2,5-6H2,(H,17,18,20)