1-(azocan-1-yl)-2-[[5-(cyclopropylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanone

Systemtic Name: 1-(azocan-1-yl)-2-[[5-(cyclopropylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanone Openeye Name: 1-(azocan-1-yl)-2-[[5-(cyclopropylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanone CAS Name: 1-(1-azocanyl)-2-[[5-(cyclopropylamino)-1,3,4-thiadiazol-2-yl]thio]ethanone IUPAC Name: 1-(azocan-1-yl)-2-[[5-(cyclopropylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanone Traditional Name: 1-(azocan-1-yl)-2-[[5-(cyclopropylamino)-1,3,4-thiadiazol-2-yl]thio]ethanone Formula: C14H22N4OS2 MolecularWeight: 326.48068

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CCC1)C(=O)CSC2=NN=C(S2)NC3CC3

Isomeric SMILES

C1CCCN(CCC1)C(=O)CSC2=NN=C(S2)NC3CC3

InChI

InChI=1S/C14H22N4OS2/c19-12(18-8-4-2-1-3-5-9-18)10-20-14-17-16-13(21-14)15-11-6-7-11/h11H,1-10H2,(H,15,16)