ethyl 4-[[5-(2-methylprop-2-enylsulfanyl)-1,3,4-thiadiazol-2-yl]amino]-4-oxidanylidene-butanoate

Systemtic Name: ethyl 4-[[5-(2-methylprop-2-enylsulfanyl)-1,3,4-thiadiazol-2-yl]amino]-4-oxidanylidene-butanoate Openeye Name: ethyl 4-[[5-(2-methylallylsulfanyl)-1,3,4-thiadiazol-2-yl]amino]-4-oxo-butanoate CAS Name: 4-[[5-(2-methylprop-2-enylthio)-1,3,4-thiadiazol-2-yl]amino]-4-oxobutanoic acid ethyl ester IUPAC Name: ethyl 4-[[5-(2-methylprop-2-enylsulfanyl)-1,3,4-thiadiazol-2-yl]amino]-4-oxobutanoate Traditional Name: 4-keto-4-[[5-(2-methylallylthio)-1,3,4-thiadiazol-2-yl]amino]butyric acid ethyl ester Formula: C12H17N3O3S2 MolecularWeight: 315.41168

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(=O)NC1=NN=C(S1)SCC(=C)C

Isomeric SMILES

CCOC(=O)CCC(=O)NC1=NN=C(S1)SCC(=C)C

InChI

InChI=1S/C12H17N3O3S2/c1-4-18-10(17)6-5-9(16)13-11-14-15-12(20-11)19-7-8(2)3/h2,4-7H2,1,3H3,(H,13,14,16)