3-[[4-fluoranyl-3-(4-propanoylpiperazin-1-yl)carbonyl-phenyl]methoxy]thiophene-2-carboxamide

Systemtic Name: 3-[[4-fluoranyl-3-(4-propanoylpiperazin-1-yl)carbonyl-phenyl]methoxy]thiophene-2-carboxamide Openeye Name: 3-[[4-fluoro-3-(4-propanoylpiperazine-1-carbonyl)phenyl]methoxy]thiophene-2-carboxamide CAS Name: 3-[[4-fluoro-3-[oxo-[4-(1-oxopropyl)-1-piperazinyl]methyl]phenyl]methoxy]-2-thiophenecarboxamide IUPAC Name: 3-[[4-fluoro-3-(4-propanoylpiperazine-1-carbonyl)phenyl]methoxy]thiophene-2-carboxamide Traditional Name: 3-[4-fluoro-3-(4-propionylpiperazine-1-carbonyl)benzyl]oxythiophene-2-carboxamide Formula: C20H22FN3O4S MolecularWeight: 419.469783

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCN(CC1)C(=O)C2=C(C=CC(=C2)COC3=C(SC=C3)C(=O)N)F

Isomeric SMILES

CCC(=O)N1CCN(CC1)C(=O)C2=C(C=CC(=C2)COC3=C(SC=C3)C(=O)N)F

InChI

InChI=1S/C20H22FN3O4S/c1-2-17(25)23-6-8-24(9-7-23)20(27)14-11-13(3-4-15(14)21)12-28-16-5-10-29-18(16)19(22)26/h3-5,10-11H,2,6-9,12H2,1H3,(H2,22,26)