N-[4-[(3,5-dimethoxyphenyl)methylsulfanylmethyl]-1,3-thiazol-2-yl]adamantane-1-carboxamide

Systemtic Name: N-[4-[(3,5-dimethoxyphenyl)methylsulfanylmethyl]-1,3-thiazol-2-yl]adamantane-1-carboxamide Openeye Name: N-[4-[(3,5-dimethoxyphenyl)methylsulfanylmethyl]thiazol-2-yl]adamantane-1-carboxamide CAS Name: N-[4-[[(3,5-dimethoxyphenyl)methylthio]methyl]-2-thiazolyl]-1-adamantanecarboxamide IUPAC Name: N-[4-[(3,5-dimethoxyphenyl)methylsulfanylmethyl]-1,3-thiazol-2-yl]adamantane-1-carboxamide Traditional Name: N-[4-[[(3,5-dimethoxybenzyl)thio]methyl]thiazol-2-yl]adamantane-1-carboxamide Formula: C24H30N2O3S2 MolecularWeight: 458.6366

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)CSCC2=CSC(=N2)NC(=O)C34CC5CC(C3)CC(C5)C4)OC

Isomeric SMILES

COC1=CC(=CC(=C1)CSCC2=CSC(=N2)NC(=O)C34CC5CC(C3)CC(C5)C4)OC

InChI

InChI=1S/C24H30N2O3S2/c1-28-20-6-18(7-21(8-20)29-2)12-30-13-19-14-31-23(25-19)26-22(27)24-9-15-3-16(10-24)5-17(4-15)11-24/h6-8,14-17H,3-5,9-13H2,1-2H3,(H,25,26,27)