1-(1-adamantyl)-2-[[4-(2-methoxyethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone

Systemtic Name: 1-(1-adamantyl)-2-[[4-(2-methoxyethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone Openeye Name: 1-(1-adamantyl)-2-[[4-(2-methoxyethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone CAS Name: 1-(1-adamantyl)-2-[[4-(2-methoxyethyl)-1,2,4-triazol-3-yl]thio]ethanone IUPAC Name: 1-(1-adamantyl)-2-[[4-(2-methoxyethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone Traditional Name: 1-(1-adamantyl)-2-[[4-(2-methoxyethyl)-1,2,4-triazol-3-yl]thio]ethanone Formula: C17H25N3O2S MolecularWeight: 335.4643

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C=NN=C1SCC(=O)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

COCCN1C=NN=C1SCC(=O)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C17H25N3O2S/c1-22-3-2-20-11-18-19-16(20)23-10-15(21)17-7-12-4-13(8-17)6-14(5-12)9-17/h11-14H,2-10H2,1H3