N-[(4-fluorophenyl)methyl]-4-(furan-2-ylmethyl)piperazine-1-carbothioamide

Systemtic Name: N-[(4-fluorophenyl)methyl]-4-(furan-2-ylmethyl)piperazine-1-carbothioamide Openeye Name: N-[(4-fluorophenyl)methyl]-4-(2-furylmethyl)piperazine-1-carbothioamide CAS Name: N-[(4-fluorophenyl)methyl]-4-(2-furanylmethyl)-1-piperazinecarbothioamide IUPAC Name: N-[(4-fluorophenyl)methyl]-4-(furan-2-ylmethyl)piperazine-1-carbothioamide Traditional Name: N-(4-fluorobenzyl)-4-(2-furfuryl)piperazine-1-carbothioamide Formula: C17H20FN3OS MolecularWeight: 333.423603

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CO2)C(=S)NCC3=CC=C(C=C3)F

Isomeric SMILES

C1CN(CCN1CC2=CC=CO2)C(=S)NCC3=CC=C(C=C3)F

InChI

InChI=1S/C17H20FN3OS/c18-15-5-3-14(4-6-15)12-19-17(23)21-9-7-20(8-10-21)13-16-2-1-11-22-16/h1-6,11H,7-10,12-13H2,(H,19,23)