(2S)-2-azanyl-N-[5-(4-pyrimidin-2-ylpiperazin-1-yl)pyridin-2-yl]propanamide

Systemtic Name: (2S)-2-azanyl-N-[5-(4-pyrimidin-2-ylpiperazin-1-yl)pyridin-2-yl]propanamide Openeye Name: (2S)-2-amino-N-[5-(4-pyrimidin-2-ylpiperazin-1-yl)-2-pyridyl]propanamide CAS Name: (2S)-2-amino-N-[5-[4-(2-pyrimidinyl)-1-piperazinyl]-2-pyridinyl]propanamide IUPAC Name: (2S)-2-amino-N-[5-(4-pyrimidin-2-ylpiperazin-1-yl)pyridin-2-yl]propanamide Traditional Name: (2S)-2-amino-N-[5-[4-(2-pyrimidyl)piperazino]-2-pyridyl]propionamide Formula: C16H21N7O MolecularWeight: 327.38424

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=NC=C(C=C1)N2CCN(CC2)C3=NC=CC=N3)N

Isomeric SMILES

C[C@@H](C(=O)NC1=NC=C(C=C1)N2CCN(CC2)C3=NC=CC=N3)N

InChI

InChI=1S/C16H21N7O/c1-12(17)15(24)21-14-4-3-13(11-20-14)22-7-9-23(10-8-22)16-18-5-2-6-19-16/h2-6,11-12H,7-10,17H2,1H3,(H,20,21,24)/t12-/m0/s1