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

Systemtic Name: ethyl 2-[5-[(5-bromanyl-4-tert-butyl-1,3-thiazol-2-yl)sulfanyl]-1,3,4-thiadiazol-2-yl]ethanoate Openeye Name: ethyl 2-[5-(5-bromo-4-tert-butyl-thiazol-2-yl)sulfanyl-1,3,4-thiadiazol-2-yl]acetate CAS Name: 2-[5-[(5-bromo-4-tert-butyl-2-thiazolyl)thio]-1,3,4-thiadiazol-2-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[5-[(5-bromo-4-tert-butyl-1,3-thiazol-2-yl)sulfanyl]-1,3,4-thiadiazol-2-yl]acetate Traditional Name: 2-[5-[(5-bromo-4-tert-butyl-thiazol-2-yl)thio]-1,3,4-thiadiazol-2-yl]acetic acid ethyl ester Formula: C13H16BrN3O2S3 MolecularWeight: 422.38404

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=NN=C(S1)SC2=NC(=C(S2)Br)C(C)(C)C

Isomeric SMILES

CCOC(=O)CC1=NN=C(S1)SC2=NC(=C(S2)Br)C(C)(C)C

InChI

InChI=1S/C13H16BrN3O2S3/c1-5-19-8(18)6-7-16-17-12(20-7)22-11-15-9(10(14)21-11)13(2,3)4/h5-6H2,1-4H3