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

Systemtic Name: 4-[[4-(4-chlorophenyl)-2-methyl-1,3-thiazol-5-yl]methoxy]-1-cyclohexyl-2-phenyl-benzimidazole-5-carboxylic acid Openeye Name: 4-[[4-(4-chlorophenyl)-2-methyl-thiazol-5-yl]methoxy]-1-cyclohexyl-2-phenyl-benzimidazole-5-carboxylic acid CAS Name: 4-[[4-(4-chlorophenyl)-2-methyl-5-thiazolyl]methoxy]-1-cyclohexyl-2-phenyl-5-benzimidazolecarboxylic acid IUPAC Name: 4-[[4-(4-chlorophenyl)-2-methyl-1,3-thiazol-5-yl]methoxy]-1-cyclohexyl-2-phenylbenzimidazole-5-carboxylic acid Traditional Name: 4-[[4-(4-chlorophenyl)-2-methyl-thiazol-5-yl]methoxy]-1-cyclohexyl-2-phenyl-benzimidazole-5-carboxylic acid Formula: C31H28ClN3O3S MolecularWeight: 558.09032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(S1)COC2=C(C=CC3=C2N=C(N3C4CCCCC4)C5=CC=CC=C5)C(=O)O)C6=CC=C(C=C6)Cl

Isomeric SMILES

CC1=NC(=C(S1)COC2=C(C=CC3=C2N=C(N3C4CCCCC4)C5=CC=CC=C5)C(=O)O)C6=CC=C(C=C6)Cl

InChI

InChI=1S/C31H28ClN3O3S/c1-19-33-27(20-12-14-22(32)15-13-20)26(39-19)18-38-29-24(31(36)37)16-17-25-28(29)34-30(21-8-4-2-5-9-21)35(25)23-10-6-3-7-11-23/h2,4-5,8-9,12-17,23H,3,6-7,10-11,18H2,1H3,(H,36,37)