N-[2,4-bis(fluoranyl)phenyl]-4-(3-chlorophenyl)piperazine-1-carbothioamide

Systemtic Name: N-[2,4-bis(fluoranyl)phenyl]-4-(3-chlorophenyl)piperazine-1-carbothioamide Openeye Name: 4-(3-chlorophenyl)-N-(2,4-difluorophenyl)piperazine-1-carbothioamide CAS Name: 4-(3-chlorophenyl)-N-(2,4-difluorophenyl)-1-piperazinecarbothioamide IUPAC Name: 4-(3-chlorophenyl)-N-(2,4-difluorophenyl)piperazine-1-carbothioamide Traditional Name: 4-(3-chlorophenyl)-N-(2,4-difluorophenyl)piperazine-1-carbothioamide Formula: C17H16ClF2N3S MolecularWeight: 367.843846

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=CC=C2)Cl)C(=S)NC3=C(C=C(C=C3)F)F

Isomeric SMILES

C1CN(CCN1C2=CC(=CC=C2)Cl)C(=S)NC3=C(C=C(C=C3)F)F

InChI

InChI=1S/C17H16ClF2N3S/c18-12-2-1-3-14(10-12)22-6-8-23(9-7-22)17(24)21-16-5-4-13(19)11-15(16)20/h1-5,10-11H,6-9H2,(H,21,24)