2-[2-[1-(2-chloranylpyridin-3-yl)-2,4-bis(oxidanylidene)pyrimidin-5-yl]quinolin-6-yl]-1-cyclohexyl-benzimidazole-5-carboxylic acid

Systemtic Name: 2-[2-[1-(2-chloranylpyridin-3-yl)-2,4-bis(oxidanylidene)pyrimidin-5-yl]quinolin-6-yl]-1-cyclohexyl-benzimidazole-5-carboxylic acid Openeye Name: 2-[2-[1-(2-chloro-3-pyridyl)-2,4-dioxo-pyrimidin-5-yl]-6-quinolyl]-1-cyclohexyl-benzimidazole-5-carboxylic acid CAS Name: 2-[2-[1-(2-chloro-3-pyridinyl)-2,4-dioxo-5-pyrimidinyl]-6-quinolinyl]-1-cyclohexyl-5-benzimidazolecarboxylic acid IUPAC Name: 2-[2-[1-(2-chloropyridin-3-yl)-2,4-dioxopyrimidin-5-yl]quinolin-6-yl]-1-cyclohexylbenzimidazole-5-carboxylic acid Traditional Name: 2-[2-[1-(2-chloro-3-pyridyl)-2,4-diketo-pyrimidin-5-yl]-6-quinolyl]-1-cyclohexyl-benzimidazole-5-carboxylic acid Formula: C32H25ClN6O4 MolecularWeight: 593.0317

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C3=C(C=C(C=C3)C(=O)O)N=C2C4=CC5=C(C=C4)N=C(C=C5)C6=CN(C(=O)NC6=O)C7=C(N=CC=C7)Cl

Isomeric SMILES

C1CCC(CC1)N2C3=C(C=C(C=C3)C(=O)O)N=C2C4=CC5=C(C=C4)N=C(C=C5)C6=CN(C(=O)NC6=O)C7=C(N=CC=C7)Cl

InChI

InChI=1S/C32H25ClN6O4/c33-28-27(7-4-14-34-28)38-17-22(30(40)37-32(38)43)24-12-8-18-15-19(9-11-23(18)35-24)29-36-25-16-20(31(41)42)10-13-26(25)39(29)21-5-2-1-3-6-21/h4,7-17,21H,1-3,5-6H2,(H,41,42)(H,37,40,43)