1,3-bis[(2,4-dimethoxyphenyl)methyl]-2-pyridin-2-yl-1,3-diazinane

Systemtic Name: 1,3-bis[(2,4-dimethoxyphenyl)methyl]-2-pyridin-2-yl-1,3-diazinane Openeye Name: 1,3-bis[(2,4-dimethoxyphenyl)methyl]-2-(2-pyridyl)hexahydropyrimidine CAS Name: 1,3-bis[(2,4-dimethoxyphenyl)methyl]-2-(2-pyridinyl)-1,3-diazinane IUPAC Name: 1,3-bis[(2,4-dimethoxyphenyl)methyl]-2-pyridin-2-yl-1,3-diazinane Traditional Name: 1,3-bis(2,4-dimethoxybenzyl)-2-(2-pyridyl)hexahydropyrimidine Formula: C27H33N3O4 MolecularWeight: 463.56862

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)CN2CCCN(C2C3=CC=CC=N3)CC4=C(C=C(C=C4)OC)OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1)CN2CCCN(C2C3=CC=CC=N3)CC4=C(C=C(C=C4)OC)OC)OC

InChI

InChI=1S/C27H33N3O4/c1-31-22-11-9-20(25(16-22)33-3)18-29-14-7-15-30(27(29)24-8-5-6-13-28-24)19-21-10-12-23(32-2)17-26(21)34-4/h5-6,8-13,16-17,27H,7,14-15,18-19H2,1-4H3