4-[3,5-bis(chloranyl)pyridin-4-yl]-N-(2-bromanyl-4-fluoranyl-phenyl)piperazine-1-carbothioamide

Systemtic Name: 4-[3,5-bis(chloranyl)pyridin-4-yl]-N-(2-bromanyl-4-fluoranyl-phenyl)piperazine-1-carbothioamide Openeye Name: N-(2-bromo-4-fluoro-phenyl)-4-(3,5-dichloro-4-pyridyl)piperazine-1-carbothioamide CAS Name: N-(2-bromo-4-fluorophenyl)-4-(3,5-dichloro-4-pyridinyl)-1-piperazinecarbothioamide IUPAC Name: N-(2-bromo-4-fluorophenyl)-4-(3,5-dichloropyridin-4-yl)piperazine-1-carbothioamide Traditional Name: N-(2-bromo-4-fluoro-phenyl)-4-(3,5-dichloro-4-pyridyl)piperazine-1-carbothioamide Formula: C16H14BrCl2FN4S MolecularWeight: 464.182563

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=NC=C2Cl)Cl)C(=S)NC3=C(C=C(C=C3)F)Br

Isomeric SMILES

C1CN(CCN1C2=C(C=NC=C2Cl)Cl)C(=S)NC3=C(C=C(C=C3)F)Br

InChI

InChI=1S/C16H14BrCl2FN4S/c17-11-7-10(20)1-2-14(11)22-16(25)24-5-3-23(4-6-24)15-12(18)8-21-9-13(15)19/h1-2,7-9H,3-6H2,(H,22,25)