2,4-bis(chloranyl)-N-[4-(2-fluorophenyl)piperazin-1-yl]carbothioyl-benzamide

Systemtic Name: 2,4-bis(chloranyl)-N-[4-(2-fluorophenyl)piperazin-1-yl]carbothioyl-benzamide Openeye Name: 2,4-dichloro-N-[4-(2-fluorophenyl)piperazine-1-carbothioyl]benzamide CAS Name: 2,4-dichloro-N-[[4-(2-fluorophenyl)-1-piperazinyl]-sulfanylidenemethyl]benzamide IUPAC Name: 2,4-dichloro-N-[4-(2-fluorophenyl)piperazine-1-carbothioyl]benzamide Traditional Name: 2,4-dichloro-N-[4-(2-fluorophenyl)piperazine-1-carbothioyl]benzamide Formula: C18H16Cl2FN3OS MolecularWeight: 412.308543

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2F)C(=S)NC(=O)C3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2F)C(=S)NC(=O)C3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C18H16Cl2FN3OS/c19-12-5-6-13(14(20)11-12)17(25)22-18(26)24-9-7-23(8-10-24)16-4-2-1-3-15(16)21/h1-6,11H,7-10H2,(H,22,25,26)