ethyl 2-[[5-(cyclohex-3-en-1-ylcarbonylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanoate

Systemtic Name: ethyl 2-[[5-(cyclohex-3-en-1-ylcarbonylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanoate Openeye Name: ethyl 2-[[5-(cyclohex-3-ene-1-carbonylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]acetate CAS Name: 2-[[5-[[1-cyclohex-3-enyl(oxo)methyl]amino]-1,3,4-thiadiazol-2-yl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[[5-(cyclohex-3-ene-1-carbonylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]acetate Traditional Name: 2-[[5-(cyclohex-3-ene-1-carbonylamino)-1,3,4-thiadiazol-2-yl]thio]acetic acid ethyl ester Formula: C13H17N3O3S2 MolecularWeight: 327.42238

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=NN=C(S1)NC(=O)C2CCC=CC2

Isomeric SMILES

CCOC(=O)CSC1=NN=C(S1)NC(=O)C2CCC=CC2

InChI

InChI=1S/C13H17N3O3S2/c1-2-19-10(17)8-20-13-16-15-12(21-13)14-11(18)9-6-4-3-5-7-9/h3-4,9H,2,5-8H2,1H3,(H,14,15,18)