2-[4-[1,2-bis(azanyl)-1-pyrimidin-2-yl-ethyl]piperazin-1-yl]-1-pyrrolidin-1-yl-ethanone

Systemtic Name: 2-[4-[1,2-bis(azanyl)-1-pyrimidin-2-yl-ethyl]piperazin-1-yl]-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-[4-(1,2-diamino-1-pyrimidin-2-yl-ethyl)piperazin-1-yl]-1-pyrrolidin-1-yl-ethanone CAS Name: 2-[4-[1,2-diamino-1-(2-pyrimidinyl)ethyl]-1-piperazinyl]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-[4-(1,2-diamino-1-pyrimidin-2-ylethyl)piperazin-1-yl]-1-pyrrolidin-1-ylethanone Traditional Name: 2-[4-[1,2-diamino-1-(2-pyrimidyl)ethyl]piperazino]-1-pyrrolidino-ethanone Formula: C16H27N7O MolecularWeight: 333.43188

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CN2CCN(CC2)C(CN)(C3=NC=CC=N3)N

Isomeric SMILES

C1CCN(C1)C(=O)CN2CCN(CC2)C(CN)(C3=NC=CC=N3)N

InChI

InChI=1S/C16H27N7O/c17-13-16(18,15-19-4-3-5-20-15)23-10-8-21(9-11-23)12-14(24)22-6-1-2-7-22/h3-5H,1-2,6-13,17-18H2