N'-(3-aminocarbonylthiophen-2-yl)-N-[[4-(4-fluoranylphenoxy)phenyl]methyl]butanediamide

Systemtic Name: N'-(3-aminocarbonylthiophen-2-yl)-N-[[4-(4-fluoranylphenoxy)phenyl]methyl]butanediamide Openeye Name: N'-(3-carbamoyl-2-thienyl)-N-[[4-(4-fluorophenoxy)phenyl]methyl]butanediamide CAS Name: N'-(3-carbamoyl-2-thiophenyl)-N-[[4-(4-fluorophenoxy)phenyl]methyl]butanediamide IUPAC Name: N'-(3-carbamoylthiophen-2-yl)-N-[[4-(4-fluorophenoxy)phenyl]methyl]butanediamide Traditional Name: N'-(3-carbamoyl-2-thienyl)-N-[4-(4-fluorophenoxy)benzyl]succinamide Formula: C22H20FN3O4S MolecularWeight: 441.475303

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC(=O)CCC(=O)NC2=C(C=CS2)C(=O)N)OC3=CC=C(C=C3)F

Isomeric SMILES

C1=CC(=CC=C1CNC(=O)CCC(=O)NC2=C(C=CS2)C(=O)N)OC3=CC=C(C=C3)F

InChI

InChI=1S/C22H20FN3O4S/c23-15-3-7-17(8-4-15)30-16-5-1-14(2-6-16)13-25-19(27)9-10-20(28)26-22-18(21(24)29)11-12-31-22/h1-8,11-12H,9-10,13H2,(H2,24,29)(H,25,27)(H,26,28)