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

Systemtic Name: ethyl 2-[[5-(3,3-dimethylbutanoylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanoate Openeye Name: ethyl 2-[[5-(3,3-dimethylbutanoylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]acetate CAS Name: 2-[[5-[(3,3-dimethyl-1-oxobutyl)amino]-1,3,4-thiadiazol-2-yl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[[5-(3,3-dimethylbutanoylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]acetate Traditional Name: 2-[[5-(3,3-dimethylbutanoylamino)-1,3,4-thiadiazol-2-yl]thio]acetic acid ethyl ester Formula: C12H19N3O3S2 MolecularWeight: 317.42756

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=NN=C(S1)NC(=O)CC(C)(C)C

Isomeric SMILES

CCOC(=O)CSC1=NN=C(S1)NC(=O)CC(C)(C)C

InChI

InChI=1S/C12H19N3O3S2/c1-5-18-9(17)7-19-11-15-14-10(20-11)13-8(16)6-12(2,3)4/h5-7H2,1-4H3,(H,13,14,16)