tert-butyl N-[6-[(2-acetamido-1,3-benzothiazol-4-yl)oxy]pyrimidin-4-yl]-N-[3-(trifluoromethyl)phenyl]carbamate

Systemtic Name: tert-butyl N-[6-[(2-acetamido-1,3-benzothiazol-4-yl)oxy]pyrimidin-4-yl]-N-[3-(trifluoromethyl)phenyl]carbamate Openeye Name: tert-butyl N-[6-[(2-acetamido-1,3-benzothiazol-4-yl)oxy]pyrimidin-4-yl]-N-[3-(trifluoromethyl)phenyl]carbamate CAS Name: N-[6-[(2-acetamido-1,3-benzothiazol-4-yl)oxy]-4-pyrimidinyl]-N-[3-(trifluoromethyl)phenyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[6-[(2-acetamido-1,3-benzothiazol-4-yl)oxy]pyrimidin-4-yl]-N-[3-(trifluoromethyl)phenyl]carbamate Traditional Name: N-[6-[(2-acetamido-1,3-benzothiazol-4-yl)oxy]pyrimidin-4-yl]-N-[3-(trifluoromethyl)phenyl]carbamic acid tert-butyl ester Formula: C25H22F3N5O4S MolecularWeight: 545.53349

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC2=C(C=CC=C2S1)OC3=NC=NC(=C3)N(C4=CC=CC(=C4)C(F)(F)F)C(=O)OC(C)(C)C

Isomeric SMILES

CC(=O)NC1=NC2=C(C=CC=C2S1)OC3=NC=NC(=C3)N(C4=CC=CC(=C4)C(F)(F)F)C(=O)OC(C)(C)C

InChI

InChI=1S/C25H22F3N5O4S/c1-14(34)31-22-32-21-17(9-6-10-18(21)38-22)36-20-12-19(29-13-30-20)33(23(35)37-24(2,3)4)16-8-5-7-15(11-16)25(26,27)28/h5-13H,1-4H3,(H,31,32,34)