N-[3-[2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-3-oxidanylidene-propyl]-2-chloranyl-benzenesulfonamide

Systemtic Name: N-[3-[2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-3-oxidanylidene-propyl]-2-chloranyl-benzenesulfonamide Openeye Name: N-[3-[2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-3-oxo-propyl]-2-chloro-benzenesulfonamide CAS Name: N-[3-[2-(1,3-benzothiazol-2-yl)-1-pyrrolidinyl]-3-oxopropyl]-2-chlorobenzenesulfonamide IUPAC Name: N-[3-[2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-3-oxopropyl]-2-chlorobenzenesulfonamide Traditional Name: N-[3-[2-(1,3-benzothiazol-2-yl)pyrrolidino]-3-keto-propyl]-2-chloro-benzenesulfonamide Formula: C20H20ClN3O3S2 MolecularWeight: 449.9741

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)CCNS(=O)(=O)C2=CC=CC=C2Cl)C3=NC4=CC=CC=C4S3

Isomeric SMILES

C1CC(N(C1)C(=O)CCNS(=O)(=O)C2=CC=CC=C2Cl)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C20H20ClN3O3S2/c21-14-6-1-4-10-18(14)29(26,27)22-12-11-19(25)24-13-5-8-16(24)20-23-15-7-2-3-9-17(15)28-20/h1-4,6-7,9-10,16,22H,5,8,11-13H2