N-(4-bromophenyl)-4-cyano-4-phenyl-piperidine-1-carbothioamide

Systemtic Name: N-(4-bromophenyl)-4-cyano-4-phenyl-piperidine-1-carbothioamide Openeye Name: N-(4-bromophenyl)-4-cyano-4-phenyl-piperidine-1-carbothioamide CAS Name: N-(4-bromophenyl)-4-cyano-4-phenyl-1-piperidinecarbothioamide IUPAC Name: N-(4-bromophenyl)-4-cyano-4-phenylpiperidine-1-carbothioamide Traditional Name: N-(4-bromophenyl)-4-cyano-4-phenyl-piperidine-1-carbothioamide Formula: C19H18BrN3S MolecularWeight: 400.33532

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(C#N)C2=CC=CC=C2)C(=S)NC3=CC=C(C=C3)Br

Isomeric SMILES

C1CN(CCC1(C#N)C2=CC=CC=C2)C(=S)NC3=CC=C(C=C3)Br

InChI

InChI=1S/C19H18BrN3S/c20-16-6-8-17(9-7-16)22-18(24)23-12-10-19(14-21,11-13-23)15-4-2-1-3-5-15/h1-9H,10-13H2,(H,22,24)