N2-(4-azanylcyclohexyl)-N1-(3-methoxyphenyl)-3-(3-methoxyphenyl)carbonyl-1,3-diazinane-1,2-dicarboxamide

Systemtic Name: N2-(4-azanylcyclohexyl)-N1-(3-methoxyphenyl)-3-(3-methoxyphenyl)carbonyl-1,3-diazinane-1,2-dicarboxamide Openeye Name: N2-(4-aminocyclohexyl)-3-(3-methoxybenzoyl)-N1-(3-methoxyphenyl)hexahydropyrimidine-1,2-dicarboxamide CAS Name: N2-(4-aminocyclohexyl)-N1-(3-methoxyphenyl)-3-[(3-methoxyphenyl)-oxomethyl]-1,3-diazinane-1,2-dicarboxamide IUPAC Name: 2-N-(4-aminocyclohexyl)-3-(3-methoxybenzoyl)-1-N-(3-methoxyphenyl)-1,3-diazinane-1,2-dicarboxamide Traditional Name: N'-(4-aminocyclohexyl)-3-m-anisoyl-N-(3-methoxyphenyl)hexahydropyrimidine-1,2-dicarboxamide Formula: C27H35N5O5 MolecularWeight: 509.5973

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)N2CCCN(C2C(=O)NC3CCC(CC3)N)C(=O)NC4=CC(=CC=C4)OC

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)N2CCCN(C2C(=O)NC3CCC(CC3)N)C(=O)NC4=CC(=CC=C4)OC

InChI

InChI=1S/C27H35N5O5/c1-36-22-8-3-6-18(16-22)26(34)31-14-5-15-32(27(35)30-21-7-4-9-23(17-21)37-2)25(31)24(33)29-20-12-10-19(28)11-13-20/h3-4,6-9,16-17,19-20,25H,5,10-15,28H2,1-2H3,(H,29,33)(H,30,35)