3-(2-chlorophenyl)-7-[(4-oxidanylcyclohexyl)amino]-1-(2-pyrrolidin-1-ylethyl)-4H-pyrimido[4,5-d]pyrimidin-2-one

Systemtic Name: 3-(2-chlorophenyl)-7-[(4-oxidanylcyclohexyl)amino]-1-(2-pyrrolidin-1-ylethyl)-4H-pyrimido[4,5-d]pyrimidin-2-one Openeye Name: 3-(2-chlorophenyl)-7-[(4-hydroxycyclohexyl)amino]-1-(2-pyrrolidin-1-ylethyl)-4H-pyrimido[4,5-d]pyrimidin-2-one CAS Name: 3-(2-chlorophenyl)-7-[(4-hydroxycyclohexyl)amino]-1-[2-(1-pyrrolidinyl)ethyl]-4H-pyrimido[4,5-d]pyrimidin-2-one IUPAC Name: 3-(2-chlorophenyl)-7-[(4-hydroxycyclohexyl)amino]-1-(2-pyrrolidin-1-ylethyl)-4H-pyrimido[4,5-d]pyrimidin-2-one Traditional Name: 3-(2-chlorophenyl)-7-[(4-hydroxycyclohexyl)amino]-1-(2-pyrrolidinoethyl)-4H-pyrimido[4,5-d]pyrimidin-2-one Formula: C24H31ClN6O2 MolecularWeight: 470.99494

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCN2C3=NC(=NC=C3CN(C2=O)C4=CC=CC=C4Cl)NC5CCC(CC5)O

Isomeric SMILES

C1CCN(C1)CCN2C3=NC(=NC=C3CN(C2=O)C4=CC=CC=C4Cl)NC5CCC(CC5)O

InChI

InChI=1S/C24H31ClN6O2/c25-20-5-1-2-6-21(20)31-16-17-15-26-23(27-18-7-9-19(32)10-8-18)28-22(17)30(24(31)33)14-13-29-11-3-4-12-29/h1-2,5-6,15,18-19,32H,3-4,7-14,16H2,(H,26,27,28)