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

Systemtic Name: tert-butyl 2-[[5-(2-thiophen-2-ylethylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanoate Openeye Name: tert-butyl 2-[[5-[2-(2-thienyl)ethylamino]-1,3,4-thiadiazol-2-yl]sulfanyl]acetate CAS Name: 2-[[5-(2-thiophen-2-ylethylamino)-1,3,4-thiadiazol-2-yl]thio]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[[5-(2-thiophen-2-ylethylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]acetate Traditional Name: 2-[[5-[2-(2-thienyl)ethylamino]-1,3,4-thiadiazol-2-yl]thio]acetic acid tert-butyl ester Formula: C14H19N3O2S3 MolecularWeight: 357.51456

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CSC1=NN=C(S1)NCCC2=CC=CS2

Isomeric SMILES

CC(C)(C)OC(=O)CSC1=NN=C(S1)NCCC2=CC=CS2

InChI

InChI=1S/C14H19N3O2S3/c1-14(2,3)19-11(18)9-21-13-17-16-12(22-13)15-7-6-10-5-4-8-20-10/h4-5,8H,6-7,9H2,1-3H3,(H,15,16)