cyanomethyl 2-[[5-(cyclohexylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanoate

Systemtic Name: cyanomethyl 2-[[5-(cyclohexylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanoate Openeye Name: cyanomethyl 2-[[5-(cyclohexylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]acetate CAS Name: 2-[[5-(cyclohexylamino)-1,3,4-thiadiazol-2-yl]thio]acetic acid cyanomethyl ester IUPAC Name: cyanomethyl 2-[[5-(cyclohexylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]acetate Traditional Name: 2-[[5-(cyclohexylamino)-1,3,4-thiadiazol-2-yl]thio]acetic acid cyanomethyl ester Formula: C12H16N4O2S2 MolecularWeight: 312.41104

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC2=NN=C(S2)SCC(=O)OCC#N

Isomeric SMILES

C1CCC(CC1)NC2=NN=C(S2)SCC(=O)OCC#N

InChI

InChI=1S/C12H16N4O2S2/c13-6-7-18-10(17)8-19-12-16-15-11(20-12)14-9-4-2-1-3-5-9/h9H,1-5,7-8H2,(H,14,15)