N-(1,3-benzothiazol-2-yl)-4-chloranyl-N-ethyl-3-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-4-chloranyl-N-ethyl-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-(1,3-benzothiazol-2-yl)-4-chloro-N-ethyl-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-(1,3-benzothiazol-2-yl)-4-chloro-N-ethyl-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-4-chloro-N-ethyl-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-(1,3-benzothiazol-2-yl)-4-chloro-N-ethyl-3-pyrrolidinosulfonyl-benzamide Formula: C20H20ClN3O3S2 MolecularWeight: 449.9741

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=NC2=CC=CC=C2S1)C(=O)C3=CC(=C(C=C3)Cl)S(=O)(=O)N4CCCC4

Isomeric SMILES

CCN(C1=NC2=CC=CC=C2S1)C(=O)C3=CC(=C(C=C3)Cl)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C20H20ClN3O3S2/c1-2-24(20-22-16-7-3-4-8-17(16)28-20)19(25)14-9-10-15(21)18(13-14)29(26,27)23-11-5-6-12-23/h3-4,7-10,13H,2,5-6,11-12H2,1H3