N-(5-chloranyl-2-phenoxy-phenyl)-4-[oxidanyl(diphenyl)methyl]piperidine-1-carbothioamide

Systemtic Name: N-(5-chloranyl-2-phenoxy-phenyl)-4-[oxidanyl(diphenyl)methyl]piperidine-1-carbothioamide Openeye Name: N-(5-chloro-2-phenoxy-phenyl)-4-[hydroxy(diphenyl)methyl]piperidine-1-carbothioamide CAS Name: N-(5-chloro-2-phenoxyphenyl)-4-[hydroxy(diphenyl)methyl]-1-piperidinecarbothioamide IUPAC Name: N-(5-chloro-2-phenoxyphenyl)-4-[hydroxy(diphenyl)methyl]piperidine-1-carbothioamide Traditional Name: N-(5-chloro-2-phenoxy-phenyl)-4-[hydroxy(diphenyl)methyl]piperidine-1-carbothioamide Formula: C31H29ClN2O2S MolecularWeight: 529.09216

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(C2=CC=CC=C2)(C3=CC=CC=C3)O)C(=S)NC4=C(C=CC(=C4)Cl)OC5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1C(C2=CC=CC=C2)(C3=CC=CC=C3)O)C(=S)NC4=C(C=CC(=C4)Cl)OC5=CC=CC=C5

InChI

InChI=1S/C31H29ClN2O2S/c32-26-16-17-29(36-27-14-8-3-9-15-27)28(22-26)33-30(37)34-20-18-25(19-21-34)31(35,23-10-4-1-5-11-23)24-12-6-2-7-13-24/h1-17,22,25,35H,18-21H2,(H,33,37)