N'-(4-carbamimidoylphenyl)-N-[2-(4-fluorophenyl)-5-oxidanylidene-oxolan-3-yl]butanediamide

Systemtic Name: N'-(4-carbamimidoylphenyl)-N-[2-(4-fluorophenyl)-5-oxidanylidene-oxolan-3-yl]butanediamide Openeye Name: N'-(4-carbamimidoylphenyl)-N-[2-(4-fluorophenyl)-5-oxo-tetrahydrofuran-3-yl]butanediamide CAS Name: N'-(4-carbamimidoylphenyl)-N-[2-(4-fluorophenyl)-5-oxo-3-oxolanyl]butanediamide IUPAC Name: N'-(4-carbamimidoylphenyl)-N-[2-(4-fluorophenyl)-5-oxooxolan-3-yl]butanediamide Traditional Name: N'-(4-amidinophenyl)-N-[2-(4-fluorophenyl)-5-keto-tetrahydrofuran-3-yl]succinamide Formula: C21H21FN4O4 MolecularWeight: 412.414243

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(OC1=O)C2=CC=C(C=C2)F)NC(=O)CCC(=O)NC3=CC=C(C=C3)C(=N)N

Isomeric SMILES

C1C(C(OC1=O)C2=CC=C(C=C2)F)NC(=O)CCC(=O)NC3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C21H21FN4O4/c22-14-5-1-12(2-6-14)20-16(11-19(29)30-20)26-18(28)10-9-17(27)25-15-7-3-13(4-8-15)21(23)24/h1-8,16,20H,9-11H2,(H3,23,24)(H,25,27)(H,26,28)