N-(5-chloranyl-1,3-benzothiazol-2-yl)-N-ethyl-3-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-(5-chloranyl-1,3-benzothiazol-2-yl)-N-ethyl-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-(5-chloro-1,3-benzothiazol-2-yl)-N-ethyl-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-(5-chloro-1,3-benzothiazol-2-yl)-N-ethyl-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-(5-chloro-1,3-benzothiazol-2-yl)-N-ethyl-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-(5-chloro-1,3-benzothiazol-2-yl)-N-ethyl-3-pyrrolidinosulfonyl-benzamide Formula: C20H20ClN3O3S2 MolecularWeight: 449.9741

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=NC2=C(S1)C=CC(=C2)Cl)C(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

CCN(C1=NC2=C(S1)C=CC(=C2)Cl)C(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C20H20ClN3O3S2/c1-2-24(20-22-17-13-15(21)8-9-18(17)28-20)19(25)14-6-5-7-16(12-14)29(26,27)23-10-3-4-11-23/h5-9,12-13H,2-4,10-11H2,1H3