N-(2,4-dimethoxyphenyl)-4-[6-ethyl-2-methyl-5-[(4-methylphenyl)methyl]pyrimidin-4-yl]-1,4-diazepane-1-carboxamide

Systemtic Name: N-(2,4-dimethoxyphenyl)-4-[6-ethyl-2-methyl-5-[(4-methylphenyl)methyl]pyrimidin-4-yl]-1,4-diazepane-1-carboxamide Openeye Name: N-(2,4-dimethoxyphenyl)-4-[6-ethyl-2-methyl-5-(p-tolylmethyl)pyrimidin-4-yl]-1,4-diazepane-1-carboxamide CAS Name: N-(2,4-dimethoxyphenyl)-4-[6-ethyl-2-methyl-5-[(4-methylphenyl)methyl]-4-pyrimidinyl]-1,4-diazepane-1-carboxamide IUPAC Name: N-(2,4-dimethoxyphenyl)-4-[6-ethyl-2-methyl-5-[(4-methylphenyl)methyl]pyrimidin-4-yl]-1,4-diazepane-1-carboxamide Traditional Name: N-(2,4-dimethoxyphenyl)-4-[6-ethyl-2-methyl-5-(4-methylbenzyl)pyrimidin-4-yl]-1,4-diazepane-1-carboxamide Formula: C29H37N5O3 MolecularWeight: 503.63578

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NC(=N1)C)N2CCCN(CC2)C(=O)NC3=C(C=C(C=C3)OC)OC)CC4=CC=C(C=C4)C

Isomeric SMILES

CCC1=C(C(=NC(=N1)C)N2CCCN(CC2)C(=O)NC3=C(C=C(C=C3)OC)OC)CC4=CC=C(C=C4)C

InChI

InChI=1S/C29H37N5O3/c1-6-25-24(18-22-10-8-20(2)9-11-22)28(31-21(3)30-25)33-14-7-15-34(17-16-33)29(35)32-26-13-12-23(36-4)19-27(26)37-5/h8-13,19H,6-7,14-18H2,1-5H3,(H,32,35)