[4-[(3-chloranyl-4-methoxy-phenyl)methylamino]-2-(3-pyridin-2-ylpropoxy)pyrimidin-5-yl]-(3,4,5-trimethoxyphenyl)methanone

Systemtic Name: [4-[(3-chloranyl-4-methoxy-phenyl)methylamino]-2-(3-pyridin-2-ylpropoxy)pyrimidin-5-yl]-(3,4,5-trimethoxyphenyl)methanone Openeye Name: [4-[(3-chloro-4-methoxy-phenyl)methylamino]-2-[3-(2-pyridyl)propoxy]pyrimidin-5-yl]-(3,4,5-trimethoxyphenyl)methanone CAS Name: [4-[(3-chloro-4-methoxyphenyl)methylamino]-2-[3-(2-pyridinyl)propoxy]-5-pyrimidinyl]-(3,4,5-trimethoxyphenyl)methanone IUPAC Name: [4-[(3-chloro-4-methoxyphenyl)methylamino]-2-(3-pyridin-2-ylpropoxy)pyrimidin-5-yl]-(3,4,5-trimethoxyphenyl)methanone Traditional Name: [4-[(3-chloro-4-methoxy-benzyl)amino]-2-[3-(2-pyridyl)propoxy]pyrimidin-5-yl]-(3,4,5-trimethoxyphenyl)methanone Formula: C30H31ClN4O6 MolecularWeight: 579.04334

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC2=NC(=NC=C2C(=O)C3=CC(=C(C(=C3)OC)OC)OC)OCCCC4=CC=CC=N4)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)CNC2=NC(=NC=C2C(=O)C3=CC(=C(C(=C3)OC)OC)OC)OCCCC4=CC=CC=N4)Cl

InChI

InChI=1S/C30H31ClN4O6/c1-37-24-11-10-19(14-23(24)31)17-33-29-22(27(36)20-15-25(38-2)28(40-4)26(16-20)39-3)18-34-30(35-29)41-13-7-9-21-8-5-6-12-32-21/h5-6,8,10-12,14-16,18H,7,9,13,17H2,1-4H3,(H,33,34,35)