tert-butyl 2-[[5-(prop-2-enylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanoate

Systemtic Name: tert-butyl 2-[[5-(prop-2-enylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanoate Openeye Name: tert-butyl 2-[[5-(allylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]acetate CAS Name: 2-[[5-(prop-2-enylamino)-1,3,4-thiadiazol-2-yl]thio]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[[5-(prop-2-enylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]acetate Traditional Name: 2-[[5-(allylamino)-1,3,4-thiadiazol-2-yl]thio]acetic acid tert-butyl ester Formula: C11H17N3O2S2 MolecularWeight: 287.40158

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CSC1=NN=C(S1)NCC=C

Isomeric SMILES

CC(C)(C)OC(=O)CSC1=NN=C(S1)NCC=C

InChI

InChI=1S/C11H17N3O2S2/c1-5-6-12-9-13-14-10(18-9)17-7-8(15)16-11(2,3)4/h5H,1,6-7H2,2-4H3,(H,12,13)