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

Systemtic Name: 3-[2-oxidanylidene-2-[4-(6-pyrrolidin-1-ylpyrimidin-4-yl)piperazin-1-yl]ethyl]-6-propan-2-yl-pyrimidin-4-one Openeye Name: 6-isopropyl-3-[2-oxo-2-[4-(6-pyrrolidin-1-ylpyrimidin-4-yl)piperazin-1-yl]ethyl]pyrimidin-4-one CAS Name: 3-[2-oxo-2-[4-[6-(1-pyrrolidinyl)-4-pyrimidinyl]-1-piperazinyl]ethyl]-6-propan-2-yl-4-pyrimidinone IUPAC Name: 3-[2-oxo-2-[4-(6-pyrrolidin-1-ylpyrimidin-4-yl)piperazin-1-yl]ethyl]-6-propan-2-ylpyrimidin-4-one Traditional Name: 6-isopropyl-3-[2-keto-2-[4-(6-pyrrolidinopyrimidin-4-yl)piperazino]ethyl]pyrimidin-4-one Formula: C21H29N7O2 MolecularWeight: 411.50066

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=O)N(C=N1)CC(=O)N2CCN(CC2)C3=NC=NC(=C3)N4CCCC4

Isomeric SMILES

CC(C)C1=CC(=O)N(C=N1)CC(=O)N2CCN(CC2)C3=NC=NC(=C3)N4CCCC4

InChI

InChI=1S/C21H29N7O2/c1-16(2)17-11-20(29)28(15-24-17)13-21(30)27-9-7-26(8-10-27)19-12-18(22-14-23-19)25-5-3-4-6-25/h11-12,14-16H,3-10,13H2,1-2H3