N-(3-chlorophenyl)-4-cyano-4-phenyl-piperidine-1-carbothioamide

Systemtic Name: N-(3-chlorophenyl)-4-cyano-4-phenyl-piperidine-1-carbothioamide Openeye Name: N-(3-chlorophenyl)-4-cyano-4-phenyl-piperidine-1-carbothioamide CAS Name: N-(3-chlorophenyl)-4-cyano-4-phenyl-1-piperidinecarbothioamide IUPAC Name: N-(3-chlorophenyl)-4-cyano-4-phenylpiperidine-1-carbothioamide Traditional Name: N-(3-chlorophenyl)-4-cyano-4-phenyl-piperidine-1-carbothioamide Formula: C19H18ClN3S MolecularWeight: 355.88432

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H18ClN3S/c20-16-7-4-8-17(13-16)22-18(24)23-11-9-19(14-21,10-12-23)15-5-2-1-3-6-15/h1-8,13H,9-12H2,(H,22,24)