(1-oxidanylidene-1-propan-2-yloxy-propan-2-yl) 5-[[3-[2-(cyclohexylcarbonylamino)ethyl]phenyl]sulfonylcarbamoyl]pyridine-2-carboxylate

Systemtic Name: (1-oxidanylidene-1-propan-2-yloxy-propan-2-yl) 5-[[3-[2-(cyclohexylcarbonylamino)ethyl]phenyl]sulfonylcarbamoyl]pyridine-2-carboxylate Openeye Name: (2-isopropoxy-1-methyl-2-oxo-ethyl) 5-[[3-[2-(cyclohexanecarbonylamino)ethyl]phenyl]sulfonylcarbamoyl]pyridine-2-carboxylate CAS Name: 5-[[[3-[2-[[cyclohexyl(oxo)methyl]amino]ethyl]phenyl]sulfonylamino]-oxomethyl]-2-pyridinecarboxylic acid (1-oxo-1-propan-2-yloxypropan-2-yl) ester IUPAC Name: (1-oxo-1-propan-2-yloxypropan-2-yl) 5-[[3-[2-(cyclohexanecarbonylamino)ethyl]phenyl]sulfonylcarbamoyl]pyridine-2-carboxylate Traditional Name: 5-[[3-[2-(cyclohexanecarbonylamino)ethyl]phenyl]sulfonylcarbamoyl]picolinic acid (2-isopropoxy-2-keto-1-methyl-ethyl) ester Formula: C28H35N3O8S MolecularWeight: 573.6578

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C(C)OC(=O)C1=NC=C(C=C1)C(=O)NS(=O)(=O)C2=CC=CC(=C2)CCNC(=O)C3CCCCC3

Isomeric SMILES

CC(C)OC(=O)C(C)OC(=O)C1=NC=C(C=C1)C(=O)NS(=O)(=O)C2=CC=CC(=C2)CCNC(=O)C3CCCCC3

InChI

InChI=1S/C28H35N3O8S/c1-18(2)38-27(34)19(3)39-28(35)24-13-12-22(17-30-24)26(33)31-40(36,37)23-11-7-8-20(16-23)14-15-29-25(32)21-9-5-4-6-10-21/h7-8,11-13,16-19,21H,4-6,9-10,14-15H2,1-3H3,(H,29,32)(H,31,33)