1-[4-(6-pyrrolidin-1-ylpyrimidin-4-yl)piperazin-1-yl]pent-4-en-1-one

Systemtic Name: 1-[4-(6-pyrrolidin-1-ylpyrimidin-4-yl)piperazin-1-yl]pent-4-en-1-one Openeye Name: 1-[4-(6-pyrrolidin-1-ylpyrimidin-4-yl)piperazin-1-yl]pent-4-en-1-one CAS Name: 1-[4-[6-(1-pyrrolidinyl)-4-pyrimidinyl]-1-piperazinyl]-4-penten-1-one IUPAC Name: 1-[4-(6-pyrrolidin-1-ylpyrimidin-4-yl)piperazin-1-yl]pent-4-en-1-one Traditional Name: 1-[4-(6-pyrrolidinopyrimidin-4-yl)piperazino]pent-4-en-1-one Formula: C17H25N5O MolecularWeight: 315.4133

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Descriptors Computed from Structure

Canonical SMILES:

C=CCCC(=O)N1CCN(CC1)C2=NC=NC(=C2)N3CCCC3

Isomeric SMILES

C=CCCC(=O)N1CCN(CC1)C2=NC=NC(=C2)N3CCCC3

InChI

InChI=1S/C17H25N5O/c1-2-3-6-17(23)22-11-9-21(10-12-22)16-13-15(18-14-19-16)20-7-4-5-8-20/h2,13-14H,1,3-12H2