N-(4-azanylcyclohexyl)-1-(3-cyclopentylpropanoyl)-3-(3-methoxyphenyl)carbonyl-1,3-diazinane-2-carboxamide

Systemtic Name: N-(4-azanylcyclohexyl)-1-(3-cyclopentylpropanoyl)-3-(3-methoxyphenyl)carbonyl-1,3-diazinane-2-carboxamide Openeye Name: N-(4-aminocyclohexyl)-1-(3-cyclopentylpropanoyl)-3-(3-methoxybenzoyl)hexahydropyrimidine-2-carboxamide CAS Name: N-(4-aminocyclohexyl)-1-(3-cyclopentyl-1-oxopropyl)-3-[(3-methoxyphenyl)-oxomethyl]-1,3-diazinane-2-carboxamide IUPAC Name: N-(4-aminocyclohexyl)-1-(3-cyclopentylpropanoyl)-3-(3-methoxybenzoyl)-1,3-diazinane-2-carboxamide Traditional Name: N-(4-aminocyclohexyl)-1-(3-cyclopentylpropanoyl)-3-m-anisoyl-hexahydropyrimidine-2-carboxamide Formula: C27H40N4O4 MolecularWeight: 484.6309

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)CCC4CCCC4

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)N2CCCN(C2C(=O)NC3CCC(CC3)N)C(=O)CCC4CCCC4

InChI

InChI=1S/C27H40N4O4/c1-35-23-9-4-8-20(18-23)27(34)31-17-5-16-30(24(32)15-10-19-6-2-3-7-19)26(31)25(33)29-22-13-11-21(28)12-14-22/h4,8-9,18-19,21-22,26H,2-3,5-7,10-17,28H2,1H3,(H,29,33)