2-[4-[[2-[(2-azanyl-2-oxidanylidene-ethoxy)methyl]-4-(4-fluorophenyl)-1,3-thiazol-5-yl]methoxy]phenyl]-1-cyclohexyl-benzimidazole-5-carboxylic acid

Systemtic Name: 2-[4-[[2-[(2-azanyl-2-oxidanylidene-ethoxy)methyl]-4-(4-fluorophenyl)-1,3-thiazol-5-yl]methoxy]phenyl]-1-cyclohexyl-benzimidazole-5-carboxylic acid Openeye Name: 2-[4-[[2-[(2-amino-2-oxo-ethoxy)methyl]-4-(4-fluorophenyl)thiazol-5-yl]methoxy]phenyl]-1-cyclohexyl-benzimidazole-5-carboxylic acid CAS Name: 2-[4-[[2-[(2-amino-2-oxoethoxy)methyl]-4-(4-fluorophenyl)-5-thiazolyl]methoxy]phenyl]-1-cyclohexyl-5-benzimidazolecarboxylic acid IUPAC Name: 2-[4-[[2-[(2-amino-2-oxoethoxy)methyl]-4-(4-fluorophenyl)-1,3-thiazol-5-yl]methoxy]phenyl]-1-cyclohexylbenzimidazole-5-carboxylic acid Traditional Name: 2-[4-[[2-[(2-amino-2-keto-ethoxy)methyl]-4-(4-fluorophenyl)thiazol-5-yl]methoxy]phenyl]-1-cyclohexyl-benzimidazole-5-carboxylic acid Formula: C33H31FN4O5S MolecularWeight: 614.686443

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C3=C(C=C(C=C3)C(=O)O)N=C2C4=CC=C(C=C4)OCC5=C(N=C(S5)COCC(=O)N)C6=CC=C(C=C6)F

Isomeric SMILES

C1CCC(CC1)N2C3=C(C=C(C=C3)C(=O)O)N=C2C4=CC=C(C=C4)OCC5=C(N=C(S5)COCC(=O)N)C6=CC=C(C=C6)F

InChI

InChI=1S/C33H31FN4O5S/c34-23-11-6-20(7-12-23)31-28(44-30(37-31)19-42-18-29(35)39)17-43-25-13-8-21(9-14-25)32-36-26-16-22(33(40)41)10-15-27(26)38(32)24-4-2-1-3-5-24/h6-16,24H,1-5,17-19H2,(H2,35,39)(H,40,41)