1-[2,4-bis(diethylamino)-6-(4-pyrrolidin-2-ylcarbonylpiperazin-1-yl)pyrimidin-5-yl]ethanone

Systemtic Name: 1-[2,4-bis(diethylamino)-6-(4-pyrrolidin-2-ylcarbonylpiperazin-1-yl)pyrimidin-5-yl]ethanone Openeye Name: 1-[2,4-bis(diethylamino)-6-[4-(pyrrolidine-2-carbonyl)piperazin-1-yl]pyrimidin-5-yl]ethanone CAS Name: 1-[2,4-bis(diethylamino)-6-[4-[oxo(2-pyrrolidinyl)methyl]-1-piperazinyl]-5-pyrimidinyl]ethanone IUPAC Name: 1-[2,4-bis(diethylamino)-6-[4-(pyrrolidine-2-carbonyl)piperazin-1-yl]pyrimidin-5-yl]ethanone Traditional Name: 1-[2,4-bis(diethylamino)-6-(4-prolylpiperazino)pyrimidin-5-yl]ethanone Formula: C23H39N7O2 MolecularWeight: 445.60146

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=NC(=NC(=C1C(=O)C)N2CCN(CC2)C(=O)C3CCCN3)N(CC)CC

Isomeric SMILES

CCN(CC)C1=NC(=NC(=C1C(=O)C)N2CCN(CC2)C(=O)C3CCCN3)N(CC)CC

InChI

InChI=1S/C23H39N7O2/c1-6-27(7-2)20-19(17(5)31)21(26-23(25-20)28(8-3)9-4)29-13-15-30(16-14-29)22(32)18-11-10-12-24-18/h18,24H,6-16H2,1-5H3