3-[2-[4-(2-methyl-6-pyrrolidin-1-yl-pyrimidin-4-yl)piperazin-1-yl]-2-oxidanylidene-ethyl]-6-propan-2-yl-pyrimidin-4-one

Systemtic Name: 3-[2-[4-(2-methyl-6-pyrrolidin-1-yl-pyrimidin-4-yl)piperazin-1-yl]-2-oxidanylidene-ethyl]-6-propan-2-yl-pyrimidin-4-one Openeye Name: 6-isopropyl-3-[2-[4-(2-methyl-6-pyrrolidin-1-yl-pyrimidin-4-yl)piperazin-1-yl]-2-oxo-ethyl]pyrimidin-4-one CAS Name: 3-[2-[4-[2-methyl-6-(1-pyrrolidinyl)-4-pyrimidinyl]-1-piperazinyl]-2-oxoethyl]-6-propan-2-yl-4-pyrimidinone IUPAC Name: 3-[2-[4-(2-methyl-6-pyrrolidin-1-ylpyrimidin-4-yl)piperazin-1-yl]-2-oxoethyl]-6-propan-2-ylpyrimidin-4-one Traditional Name: 6-isopropyl-3-[2-keto-2-[4-(2-methyl-6-pyrrolidino-pyrimidin-4-yl)piperazino]ethyl]pyrimidin-4-one Formula: C22H31N7O2 MolecularWeight: 425.52724

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC(=N1)N2CCN(CC2)C(=O)CN3C=NC(=CC3=O)C(C)C)N4CCCC4

Isomeric SMILES

CC1=NC(=CC(=N1)N2CCN(CC2)C(=O)CN3C=NC(=CC3=O)C(C)C)N4CCCC4

InChI

InChI=1S/C22H31N7O2/c1-16(2)18-12-21(30)29(15-23-18)14-22(31)28-10-8-27(9-11-28)20-13-19(24-17(3)25-20)26-6-4-5-7-26/h12-13,15-16H,4-11,14H2,1-3H3