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

Systemtic Name: 2-(1-adamantyl)-N-[4-[(3,5-dimethoxyphenyl)methylsulfanylmethyl]-1,3-thiazol-2-yl]ethanamide Openeye Name: 2-(1-adamantyl)-N-[4-[(3,5-dimethoxyphenyl)methylsulfanylmethyl]thiazol-2-yl]acetamide CAS Name: 2-(1-adamantyl)-N-[4-[[(3,5-dimethoxyphenyl)methylthio]methyl]-2-thiazolyl]acetamide IUPAC Name: 2-(1-adamantyl)-N-[4-[(3,5-dimethoxyphenyl)methylsulfanylmethyl]-1,3-thiazol-2-yl]acetamide Traditional Name: 2-(1-adamantyl)-N-[4-[[(3,5-dimethoxybenzyl)thio]methyl]thiazol-2-yl]acetamide Formula: C25H32N2O3S2 MolecularWeight: 472.66318

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)CSCC2=CSC(=N2)NC(=O)CC34CC5CC(C3)CC(C5)C4)OC

Isomeric SMILES

COC1=CC(=CC(=C1)CSCC2=CSC(=N2)NC(=O)CC34CC5CC(C3)CC(C5)C4)OC

InChI

InChI=1S/C25H32N2O3S2/c1-29-21-6-19(7-22(8-21)30-2)13-31-14-20-15-32-24(26-20)27-23(28)12-25-9-16-3-17(10-25)5-18(4-16)11-25/h6-8,15-18H,3-5,9-14H2,1-2H3,(H,26,27,28)