4-(4-ethanoyl-2-fluoranyl-phenyl)-N-(furan-2-ylmethyl)piperazine-1-carbothioamide

Systemtic Name: 4-(4-ethanoyl-2-fluoranyl-phenyl)-N-(furan-2-ylmethyl)piperazine-1-carbothioamide Openeye Name: 4-(4-acetyl-2-fluoro-phenyl)-N-(2-furylmethyl)piperazine-1-carbothioamide CAS Name: 4-(4-acetyl-2-fluorophenyl)-N-(2-furanylmethyl)-1-piperazinecarbothioamide IUPAC Name: 4-(4-acetyl-2-fluorophenyl)-N-(furan-2-ylmethyl)piperazine-1-carbothioamide Traditional Name: 4-(4-acetyl-2-fluoro-phenyl)-N-(2-furfuryl)piperazine-1-carbothioamide Formula: C18H20FN3O2S MolecularWeight: 361.433703

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=S)NCC3=CC=CO3)F

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=S)NCC3=CC=CO3)F

InChI

InChI=1S/C18H20FN3O2S/c1-13(23)14-4-5-17(16(19)11-14)21-6-8-22(9-7-21)18(25)20-12-15-3-2-10-24-15/h2-5,10-11H,6-9,12H2,1H3,(H,20,25)