N-[(2,3-dimethoxyphenyl)methyl]-4-[1-(4-phenylmethoxybutyl)imidazol-2-yl]piperidine-1-carbothioamide

Systemtic Name: N-[(2,3-dimethoxyphenyl)methyl]-4-[1-(4-phenylmethoxybutyl)imidazol-2-yl]piperidine-1-carbothioamide Openeye Name: 4-[1-(4-benzyloxybutyl)imidazol-2-yl]-N-[(2,3-dimethoxyphenyl)methyl]piperidine-1-carbothioamide CAS Name: N-[(2,3-dimethoxyphenyl)methyl]-4-[1-(4-phenylmethoxybutyl)-2-imidazolyl]-1-piperidinecarbothioamide IUPAC Name: N-[(2,3-dimethoxyphenyl)methyl]-4-[1-(4-phenylmethoxybutyl)imidazol-2-yl]piperidine-1-carbothioamide Traditional Name: 4-[1-(4-benzoxybutyl)imidazol-2-yl]-N-o-veratryl-piperidine-1-carbothioamide Formula: C29H38N4O3S MolecularWeight: 522.70202

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)CNC(=S)N2CCC(CC2)C3=NC=CN3CCCCOCC4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC(=C1OC)CNC(=S)N2CCC(CC2)C3=NC=CN3CCCCOCC4=CC=CC=C4

InChI

InChI=1S/C29H38N4O3S/c1-34-26-12-8-11-25(27(26)35-2)21-31-29(37)33-17-13-24(14-18-33)28-30-15-19-32(28)16-6-7-20-36-22-23-9-4-3-5-10-23/h3-5,8-12,15,19,24H,6-7,13-14,16-18,20-22H2,1-2H3,(H,31,37)