2-[4-methyl-5-oxidanylidene-1-(phenylcarbonyl)-4-propan-2-yl-imidazol-2-yl]-5-[1-(phenylsulfonyl)cyclopropyl]pyridine-3-carboxylic acid

Systemtic Name: 2-[4-methyl-5-oxidanylidene-1-(phenylcarbonyl)-4-propan-2-yl-imidazol-2-yl]-5-[1-(phenylsulfonyl)cyclopropyl]pyridine-3-carboxylic acid Openeye Name: 5-[1-(benzenesulfonyl)cyclopropyl]-2-(1-benzoyl-4-isopropyl-4-methyl-5-oxo-imidazol-2-yl)pyridine-3-carboxylic acid CAS Name: 5-[1-(benzenesulfonyl)cyclopropyl]-2-(1-benzoyl-4-methyl-5-oxo-4-propan-2-yl-2-imidazolyl)-3-pyridinecarboxylic acid IUPAC Name: 5-[1-(benzenesulfonyl)cyclopropyl]-2-(1-benzoyl-4-methyl-5-oxo-4-propan-2-ylimidazol-2-yl)pyridine-3-carboxylic acid Traditional Name: 2-(1-benzoyl-4-isopropyl-5-keto-4-methyl-2-imidazolin-2-yl)-5-(1-besylcyclopropyl)nicotinic acid Formula: C29H27N3O6S MolecularWeight: 545.60618

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1(C(=O)N(C(=N1)C2=NC=C(C=C2C(=O)O)C3(CC3)S(=O)(=O)C4=CC=CC=C4)C(=O)C5=CC=CC=C5)C

Isomeric SMILES

CC(C)C1(C(=O)N(C(=N1)C2=NC=C(C=C2C(=O)O)C3(CC3)S(=O)(=O)C4=CC=CC=C4)C(=O)C5=CC=CC=C5)C

InChI

InChI=1S/C29H27N3O6S/c1-18(2)28(3)27(36)32(25(33)19-10-6-4-7-11-19)24(31-28)23-22(26(34)35)16-20(17-30-23)29(14-15-29)39(37,38)21-12-8-5-9-13-21/h4-13,16-18H,14-15H2,1-3H3,(H,34,35)