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1-(1-adamantyl)-2-(3-methylquinoxalin-2-yl)sulfanyl-ethanone

1-(1-adamantyl)-2-(3-methylquinoxalin-2-yl)sulfanyl-ethanone

Systemtic Name:1-(1-adamantyl)-2-(3-methylquinoxalin-2-yl)sulfanyl-ethanone
Openeye Name:1-(1-adamantyl)-2-(3-methylquinoxalin-2-yl)sulfanyl-ethanone
CAS Name:1-(1-adamantyl)-2-[(3-methyl-2-quinoxalinyl)thio]ethanone
IUPAC Name:1-(1-adamantyl)-2-(3-methylquinoxalin-2-yl)sulfanylethanone
Traditional Name:1-(1-adamantyl)-2-[(3-methylquinoxalin-2-yl)thio]ethanone
Formula: C21H24N2OS
MolecularWeight: 352.49306
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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2N=C1SCC(=O)C34CC5CC(C3)CC(C5)C4


Isomeric SMILES

CC1=NC2=CC=CC=C2N=C1SCC(=O)C34CC5CC(C3)CC(C5)C4


InChI

InChI=1S/C21H24N2OS/c1-13-20(23-18-5-3-2-4-17(18)22-13)25-12-19(24)21-9-14-6-15(10-21)8-16(7-14)11-21/h2-5,14-16H,6-12H2,1H3


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