N2-(4-azanylcyclohexyl)-N3-(4-methoxyphenyl)-N1-prop-2-enyl-imidazolidine-1,2,3-tricarboxamide

Systemtic Name: N2-(4-azanylcyclohexyl)-N3-(4-methoxyphenyl)-N1-prop-2-enyl-imidazolidine-1,2,3-tricarboxamide Openeye Name: N1-allyl-N2-(4-aminocyclohexyl)-N3-(4-methoxyphenyl)imidazolidine-1,2,3-tricarboxamide CAS Name: N2-(4-aminocyclohexyl)-N3-(4-methoxyphenyl)-N1-prop-2-enylimidazolidine-1,2,3-tricarboxamide IUPAC Name: 2-N-(4-aminocyclohexyl)-3-N-(4-methoxyphenyl)-1-N-prop-2-enylimidazolidine-1,2,3-tricarboxamide Traditional Name: N1-allyl-N2-(4-aminocyclohexyl)-N3-(4-methoxyphenyl)imidazolidine-1,2,3-tricarboxamide Formula: C22H32N6O4 MolecularWeight: 444.52728

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)N2CCN(C2C(=O)NC3CCC(CC3)N)C(=O)NCC=C

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)N2CCN(C2C(=O)NC3CCC(CC3)N)C(=O)NCC=C

InChI

InChI=1S/C22H32N6O4/c1-3-12-24-21(30)27-13-14-28(22(31)26-17-8-10-18(32-2)11-9-17)20(27)19(29)25-16-6-4-15(23)5-7-16/h3,8-11,15-16,20H,1,4-7,12-14,23H2,2H3,(H,24,30)(H,25,29)(H,26,31)