(2S,3R)-3-(benzotriazol-1-yl)-N,2-dimethyl-heptanamide

Systemtic Name: (2S,3R)-3-(benzotriazol-1-yl)-N,2-dimethyl-heptanamide Openeye Name: (2S,3R)-3-(benzotriazol-1-yl)-N,2-dimethyl-heptanamide CAS Name: (2S,3R)-3-(1-benzotriazolyl)-N,2-dimethylheptanamide IUPAC Name: (2S,3R)-3-(benzotriazol-1-yl)-N,2-dimethylheptanamide Traditional Name: (2S,3R)-3-(benzotriazol-1-yl)-N,2-dimethyl-enanthamide Formula: C15H22N4O MolecularWeight: 274.36138

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(C)C(=O)NC)N1C2=CC=CC=C2N=N1

Isomeric SMILES

CCCC[C@H]([C@H](C)C(=O)NC)N1C2=CC=CC=C2N=N1

InChI

InChI=1S/C15H22N4O/c1-4-5-9-13(11(2)15(20)16-3)19-14-10-7-6-8-12(14)17-18-19/h6-8,10-11,13H,4-5,9H2,1-3H3,(H,16,20)/t11-,13+/m0/s1