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

Systemtic Name: N-ethyl-N-(4-methyl-1,3-benzothiazol-2-yl)-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-ethyl-N-(4-methyl-1,3-benzothiazol-2-yl)-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-ethyl-N-(4-methyl-1,3-benzothiazol-2-yl)-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-ethyl-N-(4-methyl-1,3-benzothiazol-2-yl)-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-ethyl-N-(4-methyl-1,3-benzothiazol-2-yl)-3-pyrrolidinosulfonyl-benzamide Formula: C21H23N3O3S2 MolecularWeight: 429.55562

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23N3O3S2/c1-3-24(21-22-19-15(2)8-6-11-18(19)28-21)20(25)16-9-7-10-17(14-16)29(26,27)23-12-4-5-13-23/h6-11,14H,3-5,12-13H2,1-2H3