N-[(4-fluorophenyl)methyl]-4-methanoyl-piperazine-1-carbothioamide

Systemtic Name: N-[(4-fluorophenyl)methyl]-4-methanoyl-piperazine-1-carbothioamide Openeye Name: N-[(4-fluorophenyl)methyl]-4-formyl-piperazine-1-carbothioamide CAS Name: N-[(4-fluorophenyl)methyl]-4-formyl-1-piperazinecarbothioamide IUPAC Name: N-[(4-fluorophenyl)methyl]-4-formylpiperazine-1-carbothioamide Traditional Name: N-(4-fluorobenzyl)-4-formyl-piperazine-1-carbothioamide Formula: C13H16FN3OS MolecularWeight: 281.349043

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C=O)C(=S)NCC2=CC=C(C=C2)F

Isomeric SMILES

C1CN(CCN1C=O)C(=S)NCC2=CC=C(C=C2)F

InChI

InChI=1S/C13H16FN3OS/c14-12-3-1-11(2-4-12)9-15-13(19)17-7-5-16(10-18)6-8-17/h1-4,10H,5-9H2,(H,15,19)