2,6-bis(fluoranyl)-N-(4-methanoylpiperazin-1-yl)carbothioyl-benzamide

Systemtic Name: 2,6-bis(fluoranyl)-N-(4-methanoylpiperazin-1-yl)carbothioyl-benzamide Openeye Name: 2,6-difluoro-N-(4-formylpiperazine-1-carbothioyl)benzamide CAS Name: 2,6-difluoro-N-[(4-formyl-1-piperazinyl)-sulfanylidenemethyl]benzamide IUPAC Name: 2,6-difluoro-N-(4-formylpiperazine-1-carbothioyl)benzamide Traditional Name: 2,6-difluoro-N-(4-formylpiperazine-1-carbothioyl)benzamide Formula: C13H13F2N3O2S MolecularWeight: 313.323026

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C=O)C(=S)NC(=O)C2=C(C=CC=C2F)F

Isomeric SMILES

C1CN(CCN1C=O)C(=S)NC(=O)C2=C(C=CC=C2F)F

InChI

InChI=1S/C13H13F2N3O2S/c14-9-2-1-3-10(15)11(9)12(20)16-13(21)18-6-4-17(8-19)5-7-18/h1-3,8H,4-7H2,(H,16,20,21)