3-[2,6-bis(chloranyl)-3,5-dimethoxy-phenyl]-1-methyl-1-[6-[[3-[(4-methylpiperazin-1-yl)methyl]phenyl]amino]pyrimidin-4-yl]urea

Systemtic Name: 3-[2,6-bis(chloranyl)-3,5-dimethoxy-phenyl]-1-methyl-1-[6-[[3-[(4-methylpiperazin-1-yl)methyl]phenyl]amino]pyrimidin-4-yl]urea Openeye Name: 3-(2,6-dichloro-3,5-dimethoxy-phenyl)-1-methyl-1-[6-[3-[(4-methylpiperazin-1-yl)methyl]anilino]pyrimidin-4-yl]urea CAS Name: 3-(2,6-dichloro-3,5-dimethoxyphenyl)-1-methyl-1-[6-[3-[(4-methyl-1-piperazinyl)methyl]anilino]-4-pyrimidinyl]urea IUPAC Name: 3-(2,6-dichloro-3,5-dimethoxyphenyl)-1-methyl-1-[6-[3-[(4-methylpiperazin-1-yl)methyl]anilino]pyrimidin-4-yl]urea Traditional Name: 3-(2,6-dichloro-3,5-dimethoxy-phenyl)-1-methyl-1-[6-[3-[(4-methylpiperazino)methyl]anilino]pyrimidin-4-yl]urea Formula: C26H31Cl2N7O3 MolecularWeight: 560.47544

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CC2=CC(=CC=C2)NC3=CC(=NC=N3)N(C)C(=O)NC4=C(C(=CC(=C4Cl)OC)OC)Cl

Isomeric SMILES

CN1CCN(CC1)CC2=CC(=CC=C2)NC3=CC(=NC=N3)N(C)C(=O)NC4=C(C(=CC(=C4Cl)OC)OC)Cl

InChI

InChI=1S/C26H31Cl2N7O3/c1-33-8-10-35(11-9-33)15-17-6-5-7-18(12-17)31-21-14-22(30-16-29-21)34(2)26(36)32-25-23(27)19(37-3)13-20(38-4)24(25)28/h5-7,12-14,16H,8-11,15H2,1-4H3,(H,32,36)(H,29,30,31)