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

Systemtic Name: 2-oxidanylidenepropyl 2-[[5-(cyclohexylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanoate Openeye Name: acetonyl 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 2-oxopropyl ester IUPAC Name: 2-oxopropyl 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 acetonyl ester Formula: C13H19N3O3S2 MolecularWeight: 329.43826

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)COC(=O)CSC1=NN=C(S1)NC2CCCCC2

Isomeric SMILES

CC(=O)COC(=O)CSC1=NN=C(S1)NC2CCCCC2

InChI

InChI=1S/C13H19N3O3S2/c1-9(17)7-19-11(18)8-20-13-16-15-12(21-13)14-10-5-3-2-4-6-10/h10H,2-8H2,1H3,(H,14,15)