2-[2-(1-adamantylsulfanyl)ethanoyl-methyl-amino]-N-(2,6-dimethylphenyl)ethanamide

Systemtic Name: 2-[2-(1-adamantylsulfanyl)ethanoyl-methyl-amino]-N-(2,6-dimethylphenyl)ethanamide Openeye Name: 2-[[2-(1-adamantylsulfanyl)acetyl]-methyl-amino]-N-(2,6-dimethylphenyl)acetamide CAS Name: 2-[[2-(1-adamantylthio)-1-oxoethyl]-methylamino]-N-(2,6-dimethylphenyl)acetamide IUPAC Name: 2-[[2-(1-adamantylsulfanyl)acetyl]-methylamino]-N-(2,6-dimethylphenyl)acetamide Traditional Name: 2-[[2-(1-adamantylthio)acetyl]-methyl-amino]-N-(2,6-dimethylphenyl)acetamide Formula: C23H32N2O2S MolecularWeight: 400.57738

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)CN(C)C(=O)CSC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)CN(C)C(=O)CSC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C23H32N2O2S/c1-15-5-4-6-16(2)22(15)24-20(26)13-25(3)21(27)14-28-23-10-17-7-18(11-23)9-19(8-17)12-23/h4-6,17-19H,7-14H2,1-3H3,(H,24,26)