2-[3-[2-(3,4-dimethoxyphenyl)ethyl-methyl-carbamoyl]phenyl]-N-(2-ethylhexyl)pyrimidine-5-carboxamide

Systemtic Name: 2-[3-[2-(3,4-dimethoxyphenyl)ethyl-methyl-carbamoyl]phenyl]-N-(2-ethylhexyl)pyrimidine-5-carboxamide Openeye Name: 2-[3-[2-(3,4-dimethoxyphenyl)ethyl-methyl-carbamoyl]phenyl]-N-(2-ethylhexyl)pyrimidine-5-carboxamide CAS Name: 2-[3-[[2-(3,4-dimethoxyphenyl)ethyl-methylamino]-oxomethyl]phenyl]-N-(2-ethylhexyl)-5-pyrimidinecarboxamide IUPAC Name: 2-[3-[2-(3,4-dimethoxyphenyl)ethyl-methylcarbamoyl]phenyl]-N-(2-ethylhexyl)pyrimidine-5-carboxamide Traditional Name: N-(2-ethylhexyl)-2-[3-[homoveratryl(methyl)carbamoyl]phenyl]pyrimidine-5-carboxamide Formula: C31H40N4O4 MolecularWeight: 532.6737

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CNC(=O)C1=CN=C(N=C1)C2=CC(=CC=C2)C(=O)N(C)CCC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CCCCC(CC)CNC(=O)C1=CN=C(N=C1)C2=CC(=CC=C2)C(=O)N(C)CCC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C31H40N4O4/c1-6-8-10-22(7-2)19-34-30(36)26-20-32-29(33-21-26)24-11-9-12-25(18-24)31(37)35(3)16-15-23-13-14-27(38-4)28(17-23)39-5/h9,11-14,17-18,20-22H,6-8,10,15-16,19H2,1-5H3,(H,34,36)