(2S)-1-(4-azanylpiperidin-1-yl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)propan-1-one

Systemtic Name: (2S)-1-(4-azanylpiperidin-1-yl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)propan-1-one Openeye Name: (2S)-1-(4-amino-1-piperidyl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)propan-1-one CAS Name: (2S)-1-(4-amino-1-piperidinyl)-2-[4-(2-pyrimidinyl)-1-piperazinyl]-1-propanone IUPAC Name: (2S)-1-(4-aminopiperidin-1-yl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)propan-1-one Traditional Name: (2S)-1-(4-aminopiperidino)-2-[4-(2-pyrimidyl)piperazino]propan-1-one Formula: C16H26N6O MolecularWeight: 318.41724

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCC(CC1)N)N2CCN(CC2)C3=NC=CC=N3

Isomeric SMILES

C[C@@H](C(=O)N1CCC(CC1)N)N2CCN(CC2)C3=NC=CC=N3

InChI

InChI=1S/C16H26N6O/c1-13(15(23)21-7-3-14(17)4-8-21)20-9-11-22(12-10-20)16-18-5-2-6-19-16/h2,5-6,13-14H,3-4,7-12,17H2,1H3/t13-/m0/s1