1-(azepan-1-yl)-2-[[5-(ethylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanone

Systemtic Name: 1-(azepan-1-yl)-2-[[5-(ethylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanone Openeye Name: 1-(azepan-1-yl)-2-[[5-(ethylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanone CAS Name: 1-(1-azepanyl)-2-[[5-(ethylamino)-1,3,4-thiadiazol-2-yl]thio]ethanone IUPAC Name: 1-(azepan-1-yl)-2-[[5-(ethylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanone Traditional Name: 1-(azepan-1-yl)-2-[[5-(ethylamino)-1,3,4-thiadiazol-2-yl]thio]ethanone Formula: C12H20N4OS2 MolecularWeight: 300.4434

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=NN=C(S1)SCC(=O)N2CCCCCC2

Isomeric SMILES

CCNC1=NN=C(S1)SCC(=O)N2CCCCCC2

InChI

InChI=1S/C12H20N4OS2/c1-2-13-11-14-15-12(19-11)18-9-10(17)16-7-5-3-4-6-8-16/h2-9H2,1H3,(H,13,14)