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

Systemtic Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-1-pyridin-2-yl-piperidine-3-carboxamide Openeye Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-1-(2-pyridyl)piperidine-3-carboxamide CAS Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-1-(2-pyridinyl)-3-piperidinecarboxamide IUPAC Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-1-pyridin-2-ylpiperidine-3-carboxamide Traditional Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-1-(2-pyridyl)nipecotamide Formula: C20H22N4OS MolecularWeight: 366.47988

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)SC(=N2)NC(=O)C3CCCN(C3)C4=CC=CC=N4)C

Isomeric SMILES

CC1=CC(=C2C(=C1)SC(=N2)NC(=O)C3CCCN(C3)C4=CC=CC=N4)C

InChI

InChI=1S/C20H22N4OS/c1-13-10-14(2)18-16(11-13)26-20(22-18)23-19(25)15-6-5-9-24(12-15)17-7-3-4-8-21-17/h3-4,7-8,10-11,15H,5-6,9,12H2,1-2H3,(H,22,23,25)