4-[(3-chloranyl-4-methoxy-phenyl)methylamino]-6-methoxy-2-(8-methoxy-3,4-dihydro-1H-isoquinolin-2-yl)-N-(4-oxidanylcyclohexyl)pyrimidine-5-carboxamide

Systemtic Name: 4-[(3-chloranyl-4-methoxy-phenyl)methylamino]-6-methoxy-2-(8-methoxy-3,4-dihydro-1H-isoquinolin-2-yl)-N-(4-oxidanylcyclohexyl)pyrimidine-5-carboxamide Openeye Name: 4-[(3-chloro-4-methoxy-phenyl)methylamino]-N-(4-hydroxycyclohexyl)-6-methoxy-2-(8-methoxy-3,4-dihydro-1H-isoquinolin-2-yl)pyrimidine-5-carboxamide CAS Name: 4-[(3-chloro-4-methoxyphenyl)methylamino]-N-(4-hydroxycyclohexyl)-6-methoxy-2-(8-methoxy-3,4-dihydro-1H-isoquinolin-2-yl)-5-pyrimidinecarboxamide IUPAC Name: 4-[(3-chloro-4-methoxyphenyl)methylamino]-N-(4-hydroxycyclohexyl)-6-methoxy-2-(8-methoxy-3,4-dihydro-1H-isoquinolin-2-yl)pyrimidine-5-carboxamide Traditional Name: 4-[(3-chloro-4-methoxy-benzyl)amino]-N-(4-hydroxycyclohexyl)-6-methoxy-2-(8-methoxy-3,4-dihydro-1H-isoquinolin-2-yl)pyrimidine-5-carboxamide Formula: C30H36ClN5O5 MolecularWeight: 582.09034

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC2=C(C(=NC(=N2)N3CCC4=C(C3)C(=CC=C4)OC)OC)C(=O)NC5CCC(CC5)O)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)CNC2=C(C(=NC(=N2)N3CCC4=C(C3)C(=CC=C4)OC)OC)C(=O)NC5CCC(CC5)O)Cl

InChI

InChI=1S/C30H36ClN5O5/c1-39-24-6-4-5-19-13-14-36(17-22(19)24)30-34-27(32-16-18-7-12-25(40-2)23(31)15-18)26(29(35-30)41-3)28(38)33-20-8-10-21(37)11-9-20/h4-7,12,15,20-21,37H,8-11,13-14,16-17H2,1-3H3,(H,33,38)(H,32,34,35)