3-(2-chlorophenyl)-1-methyl-7-[(4-prop-2-enoxycyclohexyl)amino]-4H-pyrimido[4,5-d]pyrimidin-2-one

Systemtic Name: 3-(2-chlorophenyl)-1-methyl-7-[(4-prop-2-enoxycyclohexyl)amino]-4H-pyrimido[4,5-d]pyrimidin-2-one Openeye Name: 7-[(4-allyloxycyclohexyl)amino]-3-(2-chlorophenyl)-1-methyl-4H-pyrimido[4,5-d]pyrimidin-2-one CAS Name: 3-(2-chlorophenyl)-1-methyl-7-[(4-prop-2-enoxycyclohexyl)amino]-4H-pyrimido[4,5-d]pyrimidin-2-one IUPAC Name: 3-(2-chlorophenyl)-1-methyl-7-[(4-prop-2-enoxycyclohexyl)amino]-4H-pyrimido[4,5-d]pyrimidin-2-one Traditional Name: 7-[(4-allyloxycyclohexyl)amino]-3-(2-chlorophenyl)-1-methyl-4H-pyrimido[4,5-d]pyrimidin-2-one Formula: C22H26ClN5O2 MolecularWeight: 427.92714

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=NC(=NC=C2CN(C1=O)C3=CC=CC=C3Cl)NC4CCC(CC4)OCC=C

Isomeric SMILES

CN1C2=NC(=NC=C2CN(C1=O)C3=CC=CC=C3Cl)NC4CCC(CC4)OCC=C

InChI

InChI=1S/C22H26ClN5O2/c1-3-12-30-17-10-8-16(9-11-17)25-21-24-13-15-14-28(19-7-5-4-6-18(19)23)22(29)27(2)20(15)26-21/h3-7,13,16-17H,1,8-12,14H2,2H3,(H,24,25,26)