S-azanyl 4-[3,5-bis(fluoranyl)phenyl]piperazine-1-carbothioate

Systemtic Name: S-azanyl 4-[3,5-bis(fluoranyl)phenyl]piperazine-1-carbothioate Openeye Name: S-amino 4-(3,5-difluorophenyl)piperazine-1-carbothioate CAS Name: 4-(3,5-difluorophenyl)-1-piperazinecarbothioic acid S-amino ester IUPAC Name: S-amino 4-(3,5-difluorophenyl)piperazine-1-carbothioate Traditional Name: 4-(3,5-difluorophenyl)piperazine-1-carbothioic acid S-amino ester Formula: C11H13F2N3OS MolecularWeight: 273.302226

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=CC(=C2)F)F)C(=O)SN

Isomeric SMILES

C1CN(CCN1C2=CC(=CC(=C2)F)F)C(=O)SN

InChI

InChI=1S/C11H13F2N3OS/c12-8-5-9(13)7-10(6-8)15-1-3-16(4-2-15)11(17)18-14/h5-7H,1-4,14H2