2-[(3R)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-N-(3-ethylpent-1-yn-3-yl)ethanamide

Systemtic Name: 2-[(3R)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-N-(3-ethylpent-1-yn-3-yl)ethanamide Openeye Name: 2-[(3R)-3-(1,3-benzothiazol-2-yl)-1-piperidyl]-N-(1,1-diethylprop-2-ynyl)acetamide CAS Name: 2-[(3R)-3-(1,3-benzothiazol-2-yl)-1-piperidinyl]-N-(3-ethylpent-1-yn-3-yl)acetamide IUPAC Name: 2-[(3R)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-N-(3-ethylpent-1-yn-3-yl)acetamide Traditional Name: 2-[(3R)-3-(1,3-benzothiazol-2-yl)piperidino]-N-(1,1-diethylprop-2-ynyl)acetamide Formula: C21H27N3OS MolecularWeight: 369.52358

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C#C)NC(=O)CN1CCCC(C1)C2=NC3=CC=CC=C3S2

Isomeric SMILES

CCC(CC)(C#C)NC(=O)CN1CCC[C@H](C1)C2=NC3=CC=CC=C3S2

InChI

InChI=1S/C21H27N3OS/c1-4-21(5-2,6-3)23-19(25)15-24-13-9-10-16(14-24)20-22-17-11-7-8-12-18(17)26-20/h1,7-8,11-12,16H,5-6,9-10,13-15H2,2-3H3,(H,23,25)/t16-/m1/s1