2-[4-[6-(3-chlorophenyl)pyrimidin-4-yl]oxyphenyl]-1-cyclohexyl-benzimidazole-5-carboxylic acid

Systemtic Name: 2-[4-[6-(3-chlorophenyl)pyrimidin-4-yl]oxyphenyl]-1-cyclohexyl-benzimidazole-5-carboxylic acid Openeye Name: 2-[4-[6-(3-chlorophenyl)pyrimidin-4-yl]oxyphenyl]-1-cyclohexyl-benzimidazole-5-carboxylic acid CAS Name: 2-[4-[[6-(3-chlorophenyl)-4-pyrimidinyl]oxy]phenyl]-1-cyclohexyl-5-benzimidazolecarboxylic acid IUPAC Name: 2-[4-[6-(3-chlorophenyl)pyrimidin-4-yl]oxyphenyl]-1-cyclohexylbenzimidazole-5-carboxylic acid Traditional Name: 2-[4-[6-(3-chlorophenyl)pyrimidin-4-yl]oxyphenyl]-1-cyclohexyl-benzimidazole-5-carboxylic acid Formula: C30H25ClN4O3 MolecularWeight: 524.9975

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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)OC5=NC=NC(=C5)C6=CC(=CC=C6)Cl

Isomeric SMILES

C1CCC(CC1)N2C3=C(C=C(C=C3)C(=O)O)N=C2C4=CC=C(C=C4)OC5=NC=NC(=C5)C6=CC(=CC=C6)Cl

InChI

InChI=1S/C30H25ClN4O3/c31-22-6-4-5-20(15-22)25-17-28(33-18-32-25)38-24-12-9-19(10-13-24)29-34-26-16-21(30(36)37)11-14-27(26)35(29)23-7-2-1-3-8-23/h4-6,9-18,23H,1-3,7-8H2,(H,36,37)