3-phenyl-4-[2-[(3,4,5-trimethoxyphenyl)amino]pyrimidin-4-yl]piperazin-2-one

Systemtic Name: 3-phenyl-4-[2-[(3,4,5-trimethoxyphenyl)amino]pyrimidin-4-yl]piperazin-2-one Openeye Name: 3-phenyl-4-[2-(3,4,5-trimethoxyanilino)pyrimidin-4-yl]piperazin-2-one CAS Name: 3-phenyl-4-[2-(3,4,5-trimethoxyanilino)-4-pyrimidinyl]-2-piperazinone IUPAC Name: 3-phenyl-4-[2-(3,4,5-trimethoxyanilino)pyrimidin-4-yl]piperazin-2-one Traditional Name: 3-phenyl-4-[2-(3,4,5-trimethoxyanilino)pyrimidin-4-yl]piperazin-2-one Formula: C23H25N5O4 MolecularWeight: 435.4757

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)NC2=NC=CC(=N2)N3CCNC(=O)C3C4=CC=CC=C4

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)NC2=NC=CC(=N2)N3CCNC(=O)C3C4=CC=CC=C4

InChI

InChI=1S/C23H25N5O4/c1-30-17-13-16(14-18(31-2)21(17)32-3)26-23-25-10-9-19(27-23)28-12-11-24-22(29)20(28)15-7-5-4-6-8-15/h4-10,13-14,20H,11-12H2,1-3H3,(H,24,29)(H,25,26,27)