4-[(3-chloranyl-4-methoxy-phenyl)methylamino]-2-[4-[4-[(3-chloranyl-4-methoxy-phenyl)methylamino]-5-[(4-oxidanylcyclohexyl)carbamoyl]pyrimidin-2-yl]piperazin-1-yl]-N-(4-oxidanylcyclohexyl)pyrimidine-5-carboxamide

Systemtic Name: 4-[(3-chloranyl-4-methoxy-phenyl)methylamino]-2-[4-[4-[(3-chloranyl-4-methoxy-phenyl)methylamino]-5-[(4-oxidanylcyclohexyl)carbamoyl]pyrimidin-2-yl]piperazin-1-yl]-N-(4-oxidanylcyclohexyl)pyrimidine-5-carboxamide Openeye Name: 4-[(3-chloro-4-methoxy-phenyl)methylamino]-2-[4-[4-[(3-chloro-4-methoxy-phenyl)methylamino]-5-[(4-hydroxycyclohexyl)carbamoyl]pyrimidin-2-yl]piperazin-1-yl]-N-(4-hydroxycyclohexyl)pyrimidine-5-carboxamide CAS Name: 4-[(3-chloro-4-methoxyphenyl)methylamino]-2-[4-[4-[(3-chloro-4-methoxyphenyl)methylamino]-5-[[(4-hydroxycyclohexyl)amino]-oxomethyl]-2-pyrimidinyl]-1-piperazinyl]-N-(4-hydroxycyclohexyl)-5-pyrimidinecarboxamide IUPAC Name: 4-[(3-chloro-4-methoxyphenyl)methylamino]-2-[4-[4-[(3-chloro-4-methoxyphenyl)methylamino]-5-[(4-hydroxycyclohexyl)carbamoyl]pyrimidin-2-yl]piperazin-1-yl]-N-(4-hydroxycyclohexyl)pyrimidine-5-carboxamide Traditional Name: 4-[(3-chloro-4-methoxy-benzyl)amino]-2-[4-[4-[(3-chloro-4-methoxy-benzyl)amino]-5-[(4-hydroxycyclohexyl)carbamoyl]pyrimidin-2-yl]piperazino]-N-(4-hydroxycyclohexyl)pyrimidine-5-carboxamide Formula: C42H52Cl2N10O6 MolecularWeight: 863.83168

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC2=NC(=NC=C2C(=O)NC3CCC(CC3)O)N4CCN(CC4)C5=NC=C(C(=N5)NCC6=CC(=C(C=C6)OC)Cl)C(=O)NC7CCC(CC7)O)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)CNC2=NC(=NC=C2C(=O)NC3CCC(CC3)O)N4CCN(CC4)C5=NC=C(C(=N5)NCC6=CC(=C(C=C6)OC)Cl)C(=O)NC7CCC(CC7)O)Cl

InChI

InChI=1S/C42H52Cl2N10O6/c1-59-35-13-3-25(19-33(35)43)21-45-37-31(39(57)49-27-5-9-29(55)10-6-27)23-47-41(51-37)53-15-17-54(18-16-53)42-48-24-32(40(58)50-28-7-11-30(56)12-8-28)38(52-42)46-22-26-4-14-36(60-2)34(44)20-26/h3-4,13-14,19-20,23-24,27-30,55-56H,5-12,15-18,21-22H2,1-2H3,(H,49,57)(H,50,58)(H,45,47,51)(H,46,48,52)