N-[3-methyl-1-oxidanylidene-1-[2-(thiophen-2-ylmethylsulfanyl)ethylamino]butan-2-yl]adamantane-1-carboxamide

Systemtic Name: N-[3-methyl-1-oxidanylidene-1-[2-(thiophen-2-ylmethylsulfanyl)ethylamino]butan-2-yl]adamantane-1-carboxamide Openeye Name: N-[2-methyl-1-[2-(2-thienylmethylsulfanyl)ethylcarbamoyl]propyl]adamantane-1-carboxamide CAS Name: N-[3-methyl-1-oxo-1-[2-(thiophen-2-ylmethylthio)ethylamino]butan-2-yl]-1-adamantanecarboxamide IUPAC Name: N-[3-methyl-1-oxo-1-[2-(thiophen-2-ylmethylsulfanyl)ethylamino]butan-2-yl]adamantane-1-carboxamide Traditional Name: N-[2-methyl-1-[2-(2-thenylthio)ethylcarbamoyl]propyl]adamantane-1-carboxamide Formula: C23H34N2O2S2 MolecularWeight: 434.65826

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NCCSCC1=CC=CS1)NC(=O)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC(C)C(C(=O)NCCSCC1=CC=CS1)NC(=O)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C23H34N2O2S2/c1-15(2)20(21(26)24-5-7-28-14-19-4-3-6-29-19)25-22(27)23-11-16-8-17(12-23)10-18(9-16)13-23/h3-4,6,15-18,20H,5,7-14H2,1-2H3,(H,24,26)(H,25,27)