N2-(4-azanylcyclohexyl)-3-(1,3-benzodioxol-5-ylcarbonyl)-N1-(3-methylphenyl)imidazolidine-1,2-dicarboxamide

Systemtic Name: N2-(4-azanylcyclohexyl)-3-(1,3-benzodioxol-5-ylcarbonyl)-N1-(3-methylphenyl)imidazolidine-1,2-dicarboxamide Openeye Name: N2-(4-aminocyclohexyl)-3-(1,3-benzodioxole-5-carbonyl)-N1-(m-tolyl)imidazolidine-1,2-dicarboxamide CAS Name: N2-(4-aminocyclohexyl)-3-[1,3-benzodioxol-5-yl(oxo)methyl]-N1-(3-methylphenyl)imidazolidine-1,2-dicarboxamide IUPAC Name: 2-N-(4-aminocyclohexyl)-3-(1,3-benzodioxole-5-carbonyl)-1-N-(3-methylphenyl)imidazolidine-1,2-dicarboxamide Traditional Name: N'-(4-aminocyclohexyl)-N-(m-tolyl)-3-piperonyloyl-imidazolidine-1,2-dicarboxamide Formula: C26H31N5O5 MolecularWeight: 493.55484

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)N2CCN(C2C(=O)NC3CCC(CC3)N)C(=O)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)N2CCN(C2C(=O)NC3CCC(CC3)N)C(=O)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C26H31N5O5/c1-16-3-2-4-20(13-16)29-26(34)31-12-11-30(24(31)23(32)28-19-8-6-18(27)7-9-19)25(33)17-5-10-21-22(14-17)36-15-35-21/h2-5,10,13-14,18-19,24H,6-9,11-12,15,27H2,1H3,(H,28,32)(H,29,34)