propan-2-yl 4-[2-[3-(tert-butylamino)-2-oxidanyl-propoxy]phenyl]-1,2,3-thiadiazole-5-carboxylate

Systemtic Name: propan-2-yl 4-[2-[3-(tert-butylamino)-2-oxidanyl-propoxy]phenyl]-1,2,3-thiadiazole-5-carboxylate Openeye Name: isopropyl 4-[2-[3-(tert-butylamino)-2-hydroxy-propoxy]phenyl]thiadiazole-5-carboxylate CAS Name: 4-[2-[3-(tert-butylamino)-2-hydroxypropoxy]phenyl]-5-thiadiazolecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[2-[3-(tert-butylamino)-2-hydroxypropoxy]phenyl]thiadiazole-5-carboxylate Traditional Name: 4-[2-[3-(tert-butylamino)-2-hydroxy-propoxy]phenyl]thiadiazole-5-carboxylic acid isopropyl ester Formula: C19H27N3O4S MolecularWeight: 393.50038

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=C(N=NS1)C2=CC=CC=C2OCC(CNC(C)(C)C)O

Isomeric SMILES

CC(C)OC(=O)C1=C(N=NS1)C2=CC=CC=C2OCC(CNC(C)(C)C)O

InChI

InChI=1S/C19H27N3O4S/c1-12(2)26-18(24)17-16(21-22-27-17)14-8-6-7-9-15(14)25-11-13(23)10-20-19(3,4)5/h6-9,12-13,20,23H,10-11H2,1-5H3