N2-(2-azanylethyl)-3-(3,4-dimethylphenyl)carbonyl-N1-(3-fluorophenyl)imidazolidine-1,2-dicarboxamide

Systemtic Name: N2-(2-azanylethyl)-3-(3,4-dimethylphenyl)carbonyl-N1-(3-fluorophenyl)imidazolidine-1,2-dicarboxamide Openeye Name: N2-(2-aminoethyl)-3-(3,4-dimethylbenzoyl)-N1-(3-fluorophenyl)imidazolidine-1,2-dicarboxamide CAS Name: N2-(2-aminoethyl)-3-[(3,4-dimethylphenyl)-oxomethyl]-N1-(3-fluorophenyl)imidazolidine-1,2-dicarboxamide IUPAC Name: 2-N-(2-aminoethyl)-3-(3,4-dimethylbenzoyl)-1-N-(3-fluorophenyl)imidazolidine-1,2-dicarboxamide Traditional Name: N'-(2-aminoethyl)-3-(3,4-dimethylbenzoyl)-N-(3-fluorophenyl)imidazolidine-1,2-dicarboxamide Formula: C22H26FN5O3 MolecularWeight: 427.471943

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N2CCN(C2C(=O)NCCN)C(=O)NC3=CC(=CC=C3)F)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N2CCN(C2C(=O)NCCN)C(=O)NC3=CC(=CC=C3)F)C

InChI

InChI=1S/C22H26FN5O3/c1-14-6-7-16(12-15(14)2)21(30)27-10-11-28(20(27)19(29)25-9-8-24)22(31)26-18-5-3-4-17(23)13-18/h3-7,12-13,20H,8-11,24H2,1-2H3,(H,25,29)(H,26,31)