4-[[[6-cyano-5-(trifluoromethyl)-1,3-benzothiazol-2-yl]carbamoyl-(4-cyclohexylphenyl)amino]methyl]-N-(2H-1,2,3,4-tetrazol-5-yl)benzamide

Systemtic Name: 4-[[[6-cyano-5-(trifluoromethyl)-1,3-benzothiazol-2-yl]carbamoyl-(4-cyclohexylphenyl)amino]methyl]-N-(2H-1,2,3,4-tetrazol-5-yl)benzamide Openeye Name: 4-[[N-[[6-cyano-5-(trifluoromethyl)-1,3-benzothiazol-2-yl]carbamoyl]-4-cyclohexyl-anilino]methyl]-N-(2H-tetrazol-5-yl)benzamide CAS Name: 4-[(N-[[[6-cyano-5-(trifluoromethyl)-1,3-benzothiazol-2-yl]amino]-oxomethyl]-4-cyclohexylanilino)methyl]-N-(2H-tetrazol-5-yl)benzamide IUPAC Name: 4-[[N-[[6-cyano-5-(trifluoromethyl)-1,3-benzothiazol-2-yl]carbamoyl]-4-cyclohexylanilino]methyl]-N-(2H-tetrazol-5-yl)benzamide Traditional Name: 4-[[N-[[6-cyano-5-(trifluoromethyl)-1,3-benzothiazol-2-yl]carbamoyl]-4-cyclohexyl-anilino]methyl]-N-(2H-tetrazol-5-yl)benzamide Formula: C31H26F3N9O2S MolecularWeight: 645.65745

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=CC=C(C=C2)N(CC3=CC=C(C=C3)C(=O)NC4=NNN=N4)C(=O)NC5=NC6=C(S5)C=C(C(=C6)C(F)(F)F)C#N

Isomeric SMILES

C1CCC(CC1)C2=CC=C(C=C2)N(CC3=CC=C(C=C3)C(=O)NC4=NNN=N4)C(=O)NC5=NC6=C(S5)C=C(C(=C6)C(F)(F)F)C#N

InChI

InChI=1S/C31H26F3N9O2S/c32-31(33,34)24-15-25-26(14-22(24)16-35)46-29(36-25)38-30(45)43(23-12-10-20(11-13-23)19-4-2-1-3-5-19)17-18-6-8-21(9-7-18)27(44)37-28-39-41-42-40-28/h6-15,19H,1-5,17H2,(H,36,38,45)(H2,37,39,40,41,42,44)