N-(3-chloranyl-2-methyl-phenyl)-4-[oxidanyl(diphenyl)methyl]piperidine-1-carbothioamide

Systemtic Name: N-(3-chloranyl-2-methyl-phenyl)-4-[oxidanyl(diphenyl)methyl]piperidine-1-carbothioamide Openeye Name: N-(3-chloro-2-methyl-phenyl)-4-[hydroxy(diphenyl)methyl]piperidine-1-carbothioamide CAS Name: N-(3-chloro-2-methylphenyl)-4-[hydroxy(diphenyl)methyl]-1-piperidinecarbothioamide IUPAC Name: N-(3-chloro-2-methylphenyl)-4-[hydroxy(diphenyl)methyl]piperidine-1-carbothioamide Traditional Name: N-(3-chloro-2-methyl-phenyl)-4-[hydroxy(diphenyl)methyl]piperidine-1-carbothioamide Formula: C26H27ClN2OS MolecularWeight: 451.02338

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=S)N2CCC(CC2)C(C3=CC=CC=C3)(C4=CC=CC=C4)O

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=S)N2CCC(CC2)C(C3=CC=CC=C3)(C4=CC=CC=C4)O

InChI

InChI=1S/C26H27ClN2OS/c1-19-23(27)13-8-14-24(19)28-25(31)29-17-15-22(16-18-29)26(30,20-9-4-2-5-10-20)21-11-6-3-7-12-21/h2-14,22,30H,15-18H2,1H3,(H,28,31)