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

Systemtic Name: N-(2-methoxy-5-methyl-phenyl)-4-[oxidanyl(diphenyl)methyl]piperidine-1-carbothioamide Openeye Name: 4-[hydroxy(diphenyl)methyl]-N-(2-methoxy-5-methyl-phenyl)piperidine-1-carbothioamide CAS Name: 4-[hydroxy(diphenyl)methyl]-N-(2-methoxy-5-methylphenyl)-1-piperidinecarbothioamide IUPAC Name: 4-[hydroxy(diphenyl)methyl]-N-(2-methoxy-5-methylphenyl)piperidine-1-carbothioamide Traditional Name: 4-[hydroxy(diphenyl)methyl]-N-(2-methoxy-5-methyl-phenyl)piperidine-1-carbothioamide Formula: C27H30N2O2S MolecularWeight: 446.6043

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)NC(=S)N2CCC(CC2)C(C3=CC=CC=C3)(C4=CC=CC=C4)O

Isomeric SMILES

CC1=CC(=C(C=C1)OC)NC(=S)N2CCC(CC2)C(C3=CC=CC=C3)(C4=CC=CC=C4)O

InChI

InChI=1S/C27H30N2O2S/c1-20-13-14-25(31-2)24(19-20)28-26(32)29-17-15-23(16-18-29)27(30,21-9-5-3-6-10-21)22-11-7-4-8-12-22/h3-14,19,23,30H,15-18H2,1-2H3,(H,28,32)