1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-N-(3-pyrrolidin-1-ylpropyl)piperidine-4-carboxamide

Systemtic Name: 1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-N-(3-pyrrolidin-1-ylpropyl)piperidine-4-carboxamide Openeye Name: 1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-N-(3-pyrrolidin-1-ylpropyl)piperidine-4-carboxamide CAS Name: 1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-N-[3-(1-pyrrolidinyl)propyl]-4-piperidinecarboxamide IUPAC Name: 1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-N-(3-pyrrolidin-1-ylpropyl)piperidine-4-carboxamide Traditional Name: 1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-N-(3-pyrrolidinopropyl)isonipecotamide Formula: C22H32N4OS MolecularWeight: 400.58068

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)SC(=N2)N3CCC(CC3)C(=O)NCCCN4CCCC4)C

Isomeric SMILES

CC1=CC(=C2C(=C1)SC(=N2)N3CCC(CC3)C(=O)NCCCN4CCCC4)C

InChI

InChI=1S/C22H32N4OS/c1-16-14-17(2)20-19(15-16)28-22(24-20)26-12-6-18(7-13-26)21(27)23-8-5-11-25-9-3-4-10-25/h14-15,18H,3-13H2,1-2H3,(H,23,27)