N-(4-bromanyl-2-chloranyl-phenyl)-4-phenyl-piperazine-1-carbothioamide

Systemtic Name: N-(4-bromanyl-2-chloranyl-phenyl)-4-phenyl-piperazine-1-carbothioamide Openeye Name: N-(4-bromo-2-chloro-phenyl)-4-phenyl-piperazine-1-carbothioamide CAS Name: N-(4-bromo-2-chlorophenyl)-4-phenyl-1-piperazinecarbothioamide IUPAC Name: N-(4-bromo-2-chlorophenyl)-4-phenylpiperazine-1-carbothioamide Traditional Name: N-(4-bromo-2-chloro-phenyl)-4-phenyl-piperazine-1-carbothioamide Formula: C17H17BrClN3S MolecularWeight: 410.75898

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17BrClN3S/c18-13-6-7-16(15(19)12-13)20-17(23)22-10-8-21(9-11-22)14-4-2-1-3-5-14/h1-7,12H,8-11H2,(H,20,23)