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

Systemtic Name: 1,3-bis[(2,4-dimethoxyphenyl)methyl]-2-(2-fluorophenyl)-1,3-diazinane Openeye Name: 1,3-bis[(2,4-dimethoxyphenyl)methyl]-2-(2-fluorophenyl)hexahydropyrimidine CAS Name: 1,3-bis[(2,4-dimethoxyphenyl)methyl]-2-(2-fluorophenyl)-1,3-diazinane IUPAC Name: 1,3-bis[(2,4-dimethoxyphenyl)methyl]-2-(2-fluorophenyl)-1,3-diazinane Traditional Name: 1,3-bis(2,4-dimethoxybenzyl)-2-(2-fluorophenyl)hexahydropyrimidine Formula: C28H33FN2O4 MolecularWeight: 480.571023

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)CN2CCCN(C2C3=CC=CC=C3F)CC4=C(C=C(C=C4)OC)OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1)CN2CCCN(C2C3=CC=CC=C3F)CC4=C(C=C(C=C4)OC)OC)OC

InChI

InChI=1S/C28H33FN2O4/c1-32-22-12-10-20(26(16-22)34-3)18-30-14-7-15-31(28(30)24-8-5-6-9-25(24)29)19-21-11-13-23(33-2)17-27(21)35-4/h5-6,8-13,16-17,28H,7,14-15,18-19H2,1-4H3