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

Systemtic Name: 1-(1-adamantyl)-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]ethanone Openeye Name: 1-(1-adamantyl)-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]ethanone CAS Name: 1-(1-adamantyl)-2-[(4-methyl-1,2,4-triazol-3-yl)thio]ethanone IUPAC Name: 1-(1-adamantyl)-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]ethanone Traditional Name: 1-(1-adamantyl)-2-[(4-methyl-1,2,4-triazol-3-yl)thio]ethanone Formula: C15H21N3OS MolecularWeight: 291.41174

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NN=C1SCC(=O)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CN1C=NN=C1SCC(=O)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C15H21N3OS/c1-18-9-16-17-14(18)20-8-13(19)15-5-10-2-11(6-15)4-12(3-10)7-15/h9-12H,2-8H2,1H3