3-[4-(3-chloranyl-4-fluoranyl-phenyl)sulfonylpiperazin-1-yl]-N-(furan-2-ylmethylcarbamoyl)propanamide

Systemtic Name: 3-[4-(3-chloranyl-4-fluoranyl-phenyl)sulfonylpiperazin-1-yl]-N-(furan-2-ylmethylcarbamoyl)propanamide Openeye Name: 3-[4-(3-chloro-4-fluoro-phenyl)sulfonylpiperazin-1-yl]-N-(2-furylmethylcarbamoyl)propanamide CAS Name: 3-[4-(3-chloro-4-fluorophenyl)sulfonyl-1-piperazinyl]-N-[(2-furanylmethylamino)-oxomethyl]propanamide IUPAC Name: 3-[4-(3-chloro-4-fluorophenyl)sulfonylpiperazin-1-yl]-N-(furan-2-ylmethylcarbamoyl)propanamide Traditional Name: 3-[4-(3-chloro-4-fluoro-phenyl)sulfonylpiperazino]-N-(2-furfurylcarbamoyl)propionamide Formula: C19H22ClFN4O5S MolecularWeight: 472.918183

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC(=O)NC(=O)NCC2=CC=CO2)S(=O)(=O)C3=CC(=C(C=C3)F)Cl

Isomeric SMILES

C1CN(CCN1CCC(=O)NC(=O)NCC2=CC=CO2)S(=O)(=O)C3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C19H22ClFN4O5S/c20-16-12-15(3-4-17(16)21)31(28,29)25-9-7-24(8-10-25)6-5-18(26)23-19(27)22-13-14-2-1-11-30-14/h1-4,11-12H,5-10,13H2,(H2,22,23,26,27)