tert-butyl N-[2-[6-(4-fluorophenyl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-3-yl]ethyl]carbamate

Systemtic Name: tert-butyl N-[2-[6-(4-fluorophenyl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-3-yl]ethyl]carbamate Openeye Name: tert-butyl N-[2-[6-(4-fluorophenyl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-3-yl]ethyl]carbamate CAS Name: N-[2-[6-(4-fluorophenyl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-3-yl]ethyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[2-[6-(4-fluorophenyl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-3-yl]ethyl]carbamate Traditional Name: N-[2-[6-(4-fluorophenyl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-3-yl]ethyl]carbamic acid tert-butyl ester Formula: C17H20FN5O2S MolecularWeight: 377.436403

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCC1=NN=C2N1NC(=CS2)C3=CC=C(C=C3)F

Isomeric SMILES

CC(C)(C)OC(=O)NCCC1=NN=C2N1NC(=CS2)C3=CC=C(C=C3)F

InChI

InChI=1S/C17H20FN5O2S/c1-17(2,3)25-16(24)19-9-8-14-20-21-15-23(14)22-13(10-26-15)11-4-6-12(18)7-5-11/h4-7,10,22H,8-9H2,1-3H3,(H,19,24)