N2-(4-azanylcyclohexyl)-3-(3-cyclopentylpropanoyl)-N1-(3-methylphenyl)-1,3-diazinane-1,2-dicarboxamide

Systemtic Name: N2-(4-azanylcyclohexyl)-3-(3-cyclopentylpropanoyl)-N1-(3-methylphenyl)-1,3-diazinane-1,2-dicarboxamide Openeye Name: N2-(4-aminocyclohexyl)-3-(3-cyclopentylpropanoyl)-N1-(m-tolyl)hexahydropyrimidine-1,2-dicarboxamide CAS Name: N2-(4-aminocyclohexyl)-3-(3-cyclopentyl-1-oxopropyl)-N1-(3-methylphenyl)-1,3-diazinane-1,2-dicarboxamide IUPAC Name: 2-N-(4-aminocyclohexyl)-3-(3-cyclopentylpropanoyl)-1-N-(3-methylphenyl)-1,3-diazinane-1,2-dicarboxamide Traditional Name: N'-(4-aminocyclohexyl)-3-(3-cyclopentylpropanoyl)-N-(m-tolyl)hexahydropyrimidine-1,2-dicarboxamide Formula: C27H41N5O3 MolecularWeight: 483.64614

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)N2CCCN(C2C(=O)NC3CCC(CC3)N)C(=O)CCC4CCCC4

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)N2CCCN(C2C(=O)NC3CCC(CC3)N)C(=O)CCC4CCCC4

InChI

InChI=1S/C27H41N5O3/c1-19-6-4-9-23(18-19)30-27(35)32-17-5-16-31(24(33)15-10-20-7-2-3-8-20)26(32)25(34)29-22-13-11-21(28)12-14-22/h4,6,9,18,20-22,26H,2-3,5,7-8,10-17,28H2,1H3,(H,29,34)(H,30,35)