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

Systemtic Name: N-(2-azanylethyl)-1-(3,4-dimethoxyphenyl)carbonyl-3-(4-fluorophenyl)sulfonyl-imidazolidine-2-carboxamide Openeye Name: N-(2-aminoethyl)-1-(3,4-dimethoxybenzoyl)-3-(4-fluorophenyl)sulfonyl-imidazolidine-2-carboxamide CAS Name: N-(2-aminoethyl)-1-[(3,4-dimethoxyphenyl)-oxomethyl]-3-(4-fluorophenyl)sulfonyl-2-imidazolidinecarboxamide IUPAC Name: N-(2-aminoethyl)-1-(3,4-dimethoxybenzoyl)-3-(4-fluorophenyl)sulfonylimidazolidine-2-carboxamide Traditional Name: N-(2-aminoethyl)-1-(4-fluorophenyl)sulfonyl-3-veratroyl-imidazolidine-2-carboxamide Formula: C21H25FN4O6S MolecularWeight: 480.509803

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25FN4O6S/c1-31-17-8-3-14(13-18(17)32-2)21(28)25-11-12-26(20(25)19(27)24-10-9-23)33(29,30)16-6-4-15(22)5-7-16/h3-8,13,20H,9-12,23H2,1-2H3,(H,24,27)