N-(2-azanylethyl)-1-(3-fluorophenyl)carbonyl-3-propylsulfonyl-imidazolidine-2-carboxamide

Systemtic Name: N-(2-azanylethyl)-1-(3-fluorophenyl)carbonyl-3-propylsulfonyl-imidazolidine-2-carboxamide Openeye Name: N-(2-aminoethyl)-1-(3-fluorobenzoyl)-3-propylsulfonyl-imidazolidine-2-carboxamide CAS Name: N-(2-aminoethyl)-1-[(3-fluorophenyl)-oxomethyl]-3-propylsulfonyl-2-imidazolidinecarboxamide IUPAC Name: N-(2-aminoethyl)-1-(3-fluorobenzoyl)-3-propylsulfonylimidazolidine-2-carboxamide Traditional Name: N-(2-aminoethyl)-1-(3-fluorobenzoyl)-3-propylsulfonyl-imidazolidine-2-carboxamide Formula: C16H23FN4O4S MolecularWeight: 386.441623

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)N1CCN(C1C(=O)NCCN)C(=O)C2=CC(=CC=C2)F

Isomeric SMILES

CCCS(=O)(=O)N1CCN(C1C(=O)NCCN)C(=O)C2=CC(=CC=C2)F

InChI

InChI=1S/C16H23FN4O4S/c1-2-10-26(24,25)21-9-8-20(15(21)14(22)19-7-6-18)16(23)12-4-3-5-13(17)11-12/h3-5,11,15H,2,6-10,18H2,1H3,(H,19,22)