(2R)-N-butyl-N-(6-methyl-1,3-benzothiazol-2-yl)-1-methylsulfonyl-pyrrolidine-2-carboxamide

Systemtic Name: (2R)-N-butyl-N-(6-methyl-1,3-benzothiazol-2-yl)-1-methylsulfonyl-pyrrolidine-2-carboxamide Openeye Name: (2R)-N-butyl-N-(6-methyl-1,3-benzothiazol-2-yl)-1-methylsulfonyl-pyrrolidine-2-carboxamide CAS Name: (2R)-N-butyl-N-(6-methyl-1,3-benzothiazol-2-yl)-1-methylsulfonyl-2-pyrrolidinecarboxamide IUPAC Name: (2R)-N-butyl-N-(6-methyl-1,3-benzothiazol-2-yl)-1-methylsulfonylpyrrolidine-2-carboxamide Traditional Name: (2R)-N-butyl-1-mesyl-N-(6-methyl-1,3-benzothiazol-2-yl)pyrrolidine-2-carboxamide Formula: C18H25N3O3S2 MolecularWeight: 395.5394

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1=NC2=C(S1)C=C(C=C2)C)C(=O)C3CCCN3S(=O)(=O)C

Isomeric SMILES

CCCCN(C1=NC2=C(S1)C=C(C=C2)C)C(=O)[C@H]3CCCN3S(=O)(=O)C

InChI

InChI=1S/C18H25N3O3S2/c1-4-5-10-20(17(22)15-7-6-11-21(15)26(3,23)24)18-19-14-9-8-13(2)12-16(14)25-18/h8-9,12,15H,4-7,10-11H2,1-3H3/t15-/m1/s1