2-[[5-[2-(1-adamantylamino)-2-oxidanylidene-ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]sulfanyl]ethanamide

Systemtic Name: 2-[[5-[2-(1-adamantylamino)-2-oxidanylidene-ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]sulfanyl]ethanamide Openeye Name: 2-[[5-[2-(1-adamantylamino)-2-oxo-ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]sulfanyl]acetamide CAS Name: 2-[[5-[[2-(1-adamantylamino)-2-oxoethyl]thio]-1,3,4-thiadiazol-2-yl]thio]acetamide IUPAC Name: 2-[[5-[2-(1-adamantylamino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]sulfanyl]acetamide Traditional Name: 2-[[5-[[2-(1-adamantylamino)-2-keto-ethyl]thio]-1,3,4-thiadiazol-2-yl]thio]acetamide Formula: C16H22N4O2S3 MolecularWeight: 398.56648

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC(=O)CSC4=NN=C(S4)SCC(=O)N

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC(=O)CSC4=NN=C(S4)SCC(=O)N

InChI

InChI=1S/C16H22N4O2S3/c17-12(21)7-23-14-19-20-15(25-14)24-8-13(22)18-16-4-9-1-10(5-16)3-11(2-9)6-16/h9-11H,1-8H2,(H2,17,21)(H,18,22)