7-[[5-chloranyl-2-[[2-methoxy-4-(4-propan-2-ylpiperazin-1-yl)phenyl]amino]pyrimidin-4-yl]amino]-2-methyl-3H-isoindol-1-one

Systemtic Name: 7-[[5-chloranyl-2-[[2-methoxy-4-(4-propan-2-ylpiperazin-1-yl)phenyl]amino]pyrimidin-4-yl]amino]-2-methyl-3H-isoindol-1-one Openeye Name: 7-[[5-chloro-2-[4-(4-isopropylpiperazin-1-yl)-2-methoxy-anilino]pyrimidin-4-yl]amino]-2-methyl-isoindolin-1-one CAS Name: 7-[[5-chloro-2-[2-methoxy-4-(4-propan-2-yl-1-piperazinyl)anilino]-4-pyrimidinyl]amino]-2-methyl-3H-isoindol-1-one IUPAC Name: 7-[[5-chloro-2-[2-methoxy-4-(4-propan-2-ylpiperazin-1-yl)anilino]pyrimidin-4-yl]amino]-2-methyl-3H-isoindol-1-one Traditional Name: 7-[[5-chloro-2-[4-(4-isopropylpiperazino)-2-methoxy-anilino]pyrimidin-4-yl]amino]-2-methyl-isoindolin-1-one Formula: C27H32ClN7O2 MolecularWeight: 522.04168

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CCN(CC1)C2=CC(=C(C=C2)NC3=NC=C(C(=N3)NC4=CC=CC5=C4C(=O)N(C5)C)Cl)OC

Isomeric SMILES

CC(C)N1CCN(CC1)C2=CC(=C(C=C2)NC3=NC=C(C(=N3)NC4=CC=CC5=C4C(=O)N(C5)C)Cl)OC

InChI

InChI=1S/C27H32ClN7O2/c1-17(2)34-10-12-35(13-11-34)19-8-9-21(23(14-19)37-4)31-27-29-15-20(28)25(32-27)30-22-7-5-6-18-16-33(3)26(36)24(18)22/h5-9,14-15,17H,10-13,16H2,1-4H3,(H2,29,30,31,32)