3-methyl-4-[[2-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]quinazolin-4-yl]amino]phenol

Systemtic Name: 3-methyl-4-[[2-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]quinazolin-4-yl]amino]phenol Openeye Name: 3-methyl-4-[[2-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]quinazolin-4-yl]amino]phenol CAS Name: 3-methyl-4-[[2-[[4-(2-pyrimidinyl)-1-piperazinyl]methyl]-4-quinazolinyl]amino]phenol IUPAC Name: 3-methyl-4-[[2-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]quinazolin-4-yl]amino]phenol Traditional Name: 3-methyl-4-[[2-[[4-(2-pyrimidyl)piperazino]methyl]quinazolin-4-yl]amino]phenol Formula: C24H25N7O MolecularWeight: 427.5016

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)O)NC2=NC(=NC3=CC=CC=C32)CN4CCN(CC4)C5=NC=CC=N5

Isomeric SMILES

CC1=C(C=CC(=C1)O)NC2=NC(=NC3=CC=CC=C32)CN4CCN(CC4)C5=NC=CC=N5

InChI

InChI=1S/C24H25N7O/c1-17-15-18(32)7-8-20(17)28-23-19-5-2-3-6-21(19)27-22(29-23)16-30-11-13-31(14-12-30)24-25-9-4-10-26-24/h2-10,15,32H,11-14,16H2,1H3,(H,27,28,29)