4-[[(4-tert-butylphenyl)-[[5-(trifluoromethyloxy)-1,3-benzothiazol-2-yl]carbamoyl]amino]methyl]-N-(2H-1,2,3,4-tetrazol-5-yl)benzamide

Systemtic Name: 4-[[(4-tert-butylphenyl)-[[5-(trifluoromethyloxy)-1,3-benzothiazol-2-yl]carbamoyl]amino]methyl]-N-(2H-1,2,3,4-tetrazol-5-yl)benzamide Openeye Name: 4-[[4-tert-butyl-N-[[5-(trifluoromethoxy)-1,3-benzothiazol-2-yl]carbamoyl]anilino]methyl]-N-(2H-tetrazol-5-yl)benzamide CAS Name: 4-[(4-tert-butyl-N-[oxo-[[5-(trifluoromethoxy)-1,3-benzothiazol-2-yl]amino]methyl]anilino)methyl]-N-(2H-tetrazol-5-yl)benzamide IUPAC Name: 4-[[4-tert-butyl-N-[[5-(trifluoromethoxy)-1,3-benzothiazol-2-yl]carbamoyl]anilino]methyl]-N-(2H-tetrazol-5-yl)benzamide Traditional Name: 4-[[4-tert-butyl-N-[[5-(trifluoromethoxy)-1,3-benzothiazol-2-yl]carbamoyl]anilino]methyl]-N-(2H-tetrazol-5-yl)benzamide Formula: C28H25F3N8O3S MolecularWeight: 610.61011

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)N(CC2=CC=C(C=C2)C(=O)NC3=NNN=N3)C(=O)NC4=NC5=C(S4)C=CC(=C5)OC(F)(F)F

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)N(CC2=CC=C(C=C2)C(=O)NC3=NNN=N3)C(=O)NC4=NC5=C(S4)C=CC(=C5)OC(F)(F)F

InChI

InChI=1S/C28H25F3N8O3S/c1-27(2,3)18-8-10-19(11-9-18)39(15-16-4-6-17(7-5-16)23(40)33-24-35-37-38-36-24)26(41)34-25-32-21-14-20(42-28(29,30)31)12-13-22(21)43-25/h4-14H,15H2,1-3H3,(H,32,34,41)(H2,33,35,36,37,38,40)