4-[1-[(3,5-dimethoxyphenyl)methyl]imidazol-2-yl]-N-(3-methylsulfanylphenyl)piperidine-1-carbothioamide

Systemtic Name: 4-[1-[(3,5-dimethoxyphenyl)methyl]imidazol-2-yl]-N-(3-methylsulfanylphenyl)piperidine-1-carbothioamide Openeye Name: 4-[1-[(3,5-dimethoxyphenyl)methyl]imidazol-2-yl]-N-(3-methylsulfanylphenyl)piperidine-1-carbothioamide CAS Name: 4-[1-[(3,5-dimethoxyphenyl)methyl]-2-imidazolyl]-N-[3-(methylthio)phenyl]-1-piperidinecarbothioamide IUPAC Name: 4-[1-[(3,5-dimethoxyphenyl)methyl]imidazol-2-yl]-N-(3-methylsulfanylphenyl)piperidine-1-carbothioamide Traditional Name: 4-[1-(3,5-dimethoxybenzyl)imidazol-2-yl]-N-[3-(methylthio)phenyl]piperidine-1-carbothioamide Formula: C25H30N4O2S2 MolecularWeight: 482.6613

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)CN2C=CN=C2C3CCN(CC3)C(=S)NC4=CC(=CC=C4)SC)OC

Isomeric SMILES

COC1=CC(=CC(=C1)CN2C=CN=C2C3CCN(CC3)C(=S)NC4=CC(=CC=C4)SC)OC

InChI

InChI=1S/C25H30N4O2S2/c1-30-21-13-18(14-22(16-21)31-2)17-29-12-9-26-24(29)19-7-10-28(11-8-19)25(32)27-20-5-4-6-23(15-20)33-3/h4-6,9,12-16,19H,7-8,10-11,17H2,1-3H3,(H,27,32)