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

Systemtic Name: N-(2,3-dihydro-1H-inden-5-yl)-4-[1-[(3,5-dimethoxyphenyl)methyl]imidazol-2-yl]piperidine-1-carbothioamide Openeye Name: 4-[1-[(3,5-dimethoxyphenyl)methyl]imidazol-2-yl]-N-indan-5-yl-piperidine-1-carbothioamide CAS Name: N-(2,3-dihydro-1H-inden-5-yl)-4-[1-[(3,5-dimethoxyphenyl)methyl]-2-imidazolyl]-1-piperidinecarbothioamide IUPAC Name: N-(2,3-dihydro-1H-inden-5-yl)-4-[1-[(3,5-dimethoxyphenyl)methyl]imidazol-2-yl]piperidine-1-carbothioamide Traditional Name: 4-[1-(3,5-dimethoxybenzyl)imidazol-2-yl]-N-indan-5-yl-piperidine-1-carbothioamide Formula: C27H32N4O2S MolecularWeight: 476.63358

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)CN2C=CN=C2C3CCN(CC3)C(=S)NC4=CC5=C(CCC5)C=C4)OC

Isomeric SMILES

COC1=CC(=CC(=C1)CN2C=CN=C2C3CCN(CC3)C(=S)NC4=CC5=C(CCC5)C=C4)OC

InChI

InChI=1S/C27H32N4O2S/c1-32-24-14-19(15-25(17-24)33-2)18-31-13-10-28-26(31)21-8-11-30(12-9-21)27(34)29-23-7-6-20-4-3-5-22(20)16-23/h6-7,10,13-17,21H,3-5,8-9,11-12,18H2,1-2H3,(H,29,34)