2-azanyl-3-(1H-imidazol-2-ylmethylamino)-1-piperidin-1-yl-propan-1-one

Systemtic Name: 2-azanyl-3-(1H-imidazol-2-ylmethylamino)-1-piperidin-1-yl-propan-1-one Openeye Name: 2-amino-3-(1H-imidazol-2-ylmethylamino)-1-(1-piperidyl)propan-1-one CAS Name: 2-amino-3-(1H-imidazol-2-ylmethylamino)-1-(1-piperidinyl)-1-propanone IUPAC Name: 2-amino-3-(1H-imidazol-2-ylmethylamino)-1-piperidin-1-ylpropan-1-one Traditional Name: 2-amino-3-(1H-imidazol-2-ylmethylamino)-1-piperidino-propan-1-one Formula: C12H21N5O MolecularWeight: 251.32804

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C(CNCC2=NC=CN2)N

Isomeric SMILES

C1CCN(CC1)C(=O)C(CNCC2=NC=CN2)N

InChI

InChI=1S/C12H21N5O/c13-10(8-14-9-11-15-4-5-16-11)12(18)17-6-2-1-3-7-17/h4-5,10,14H,1-3,6-9,13H2,(H,15,16)