N2-(2-azanylethyl)-N3-(3-bromophenyl)-N1-(4-methoxyphenyl)imidazolidine-1,2,3-tricarboxamide

Systemtic Name: N2-(2-azanylethyl)-N3-(3-bromophenyl)-N1-(4-methoxyphenyl)imidazolidine-1,2,3-tricarboxamide Openeye Name: N2-(2-aminoethyl)-N3-(3-bromophenyl)-N1-(4-methoxyphenyl)imidazolidine-1,2,3-tricarboxamide CAS Name: N2-(2-aminoethyl)-N3-(3-bromophenyl)-N1-(4-methoxyphenyl)imidazolidine-1,2,3-tricarboxamide IUPAC Name: 2-N-(2-aminoethyl)-3-N-(3-bromophenyl)-1-N-(4-methoxyphenyl)imidazolidine-1,2,3-tricarboxamide Traditional Name: N2-(2-aminoethyl)-N3-(3-bromophenyl)-N1-(4-methoxyphenyl)imidazolidine-1,2,3-tricarboxamide Formula: C21H25BrN6O4 MolecularWeight: 505.365

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)N2CCN(C2C(=O)NCCN)C(=O)NC3=CC(=CC=C3)Br

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)N2CCN(C2C(=O)NCCN)C(=O)NC3=CC(=CC=C3)Br

InChI

InChI=1S/C21H25BrN6O4/c1-32-17-7-5-15(6-8-17)25-20(30)27-11-12-28(19(27)18(29)24-10-9-23)21(31)26-16-4-2-3-14(22)13-16/h2-8,13,19H,9-12,23H2,1H3,(H,24,29)(H,25,30)(H,26,31)