N-(2-azanylethyl)-1-(3,4-dimethoxyphenyl)carbonyl-3-(3-fluorophenyl)carbonyl-imidazolidine-2-carboxamide

Systemtic Name: N-(2-azanylethyl)-1-(3,4-dimethoxyphenyl)carbonyl-3-(3-fluorophenyl)carbonyl-imidazolidine-2-carboxamide Openeye Name: N-(2-aminoethyl)-1-(3,4-dimethoxybenzoyl)-3-(3-fluorobenzoyl)imidazolidine-2-carboxamide CAS Name: N-(2-aminoethyl)-1-[(3,4-dimethoxyphenyl)-oxomethyl]-3-[(3-fluorophenyl)-oxomethyl]-2-imidazolidinecarboxamide IUPAC Name: N-(2-aminoethyl)-1-(3,4-dimethoxybenzoyl)-3-(3-fluorobenzoyl)imidazolidine-2-carboxamide Traditional Name: N-(2-aminoethyl)-1-(3-fluorobenzoyl)-3-veratroyl-imidazolidine-2-carboxamide Formula: C22H25FN4O5 MolecularWeight: 444.456103

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)N2CCN(C2C(=O)NCCN)C(=O)C3=CC(=CC=C3)F)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N2CCN(C2C(=O)NCCN)C(=O)C3=CC(=CC=C3)F)OC

InChI

InChI=1S/C22H25FN4O5/c1-31-17-7-6-15(13-18(17)32-2)22(30)27-11-10-26(20(27)19(28)25-9-8-24)21(29)14-4-3-5-16(23)12-14/h3-7,12-13,20H,8-11,24H2,1-2H3,(H,25,28)