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

Systemtic Name: tert-butyl 2-[[5-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-1,3,4-thiadiazol-2-yl]sulfanyl]ethanoate Openeye Name: tert-butyl 2-[[5-(2-amino-2-oxo-ethyl)sulfanyl-1,3,4-thiadiazol-2-yl]sulfanyl]acetate CAS Name: 2-[[5-[(2-amino-2-oxoethyl)thio]-1,3,4-thiadiazol-2-yl]thio]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[[5-(2-amino-2-oxoethyl)sulfanyl-1,3,4-thiadiazol-2-yl]sulfanyl]acetate Traditional Name: 2-[[5-[(2-amino-2-keto-ethyl)thio]-1,3,4-thiadiazol-2-yl]thio]acetic acid tert-butyl ester Formula: C10H15N3O3S3 MolecularWeight: 321.4394

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CSC1=NN=C(S1)SCC(=O)N

Isomeric SMILES

CC(C)(C)OC(=O)CSC1=NN=C(S1)SCC(=O)N

InChI

InChI=1S/C10H15N3O3S3/c1-10(2,3)16-7(15)5-18-9-13-12-8(19-9)17-4-6(11)14/h4-5H2,1-3H3,(H2,11,14)