N-[1,3-benzothiazol-2-yl(oxidanyl)methyl]-N-butyl-pyrrolidine-2-carboxamide

Systemtic Name: N-[1,3-benzothiazol-2-yl(oxidanyl)methyl]-N-butyl-pyrrolidine-2-carboxamide Openeye Name: N-[1,3-benzothiazol-2-yl(hydroxy)methyl]-N-butyl-pyrrolidine-2-carboxamide CAS Name: N-[1,3-benzothiazol-2-yl(hydroxy)methyl]-N-butyl-2-pyrrolidinecarboxamide IUPAC Name: N-[1,3-benzothiazol-2-yl(hydroxy)methyl]-N-butylpyrrolidine-2-carboxamide Traditional Name: N-[1,3-benzothiazol-2-yl(hydroxy)methyl]-N-butyl-pyrrolidine-2-carboxamide Formula: C17H23N3O2S MolecularWeight: 333.44842

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C(C1=NC2=CC=CC=C2S1)O)C(=O)C3CCCN3

Isomeric SMILES

CCCCN(C(C1=NC2=CC=CC=C2S1)O)C(=O)C3CCCN3

InChI

InChI=1S/C17H23N3O2S/c1-2-3-11-20(16(21)13-8-6-10-18-13)17(22)15-19-12-7-4-5-9-14(12)23-15/h4-5,7,9,13,17-18,22H,2-3,6,8,10-11H2,1H3