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

Systemtic Name: (2-azanyl-2-oxidanylidene-ethyl) 2-[[5-(cyclohexylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanoate Openeye Name: (2-amino-2-oxo-ethyl) 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-amino-2-oxoethyl) ester IUPAC Name: (2-amino-2-oxoethyl) 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 (2-amino-2-keto-ethyl) ester Formula: C12H18N4O3S2 MolecularWeight: 330.42632

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H18N4O3S2/c13-9(17)6-19-10(18)7-20-12-16-15-11(21-12)14-8-4-2-1-3-5-8/h8H,1-7H2,(H2,13,17)(H,14,15)