1-(1-adamantyl)-2-[[5-(2-methylpropylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanone

Systemtic Name: 1-(1-adamantyl)-2-[[5-(2-methylpropylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanone Openeye Name: 1-(1-adamantyl)-2-[[5-(isobutylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanone CAS Name: 1-(1-adamantyl)-2-[[5-(2-methylpropylamino)-1,3,4-thiadiazol-2-yl]thio]ethanone IUPAC Name: 1-(1-adamantyl)-2-[[5-(2-methylpropylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanone Traditional Name: 1-(1-adamantyl)-2-[[5-(isobutylamino)-1,3,4-thiadiazol-2-yl]thio]ethanone Formula: C18H27N3OS2 MolecularWeight: 365.55648

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC1=NN=C(S1)SCC(=O)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC(C)CNC1=NN=C(S1)SCC(=O)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C18H27N3OS2/c1-11(2)9-19-16-20-21-17(24-16)23-10-15(22)18-6-12-3-13(7-18)5-14(4-12)8-18/h11-14H,3-10H2,1-2H3,(H,19,20)