pentan-3-yl 5-[[4-[2-[(4-ethoxyphenyl)carbonylamino]ethyl]phenyl]sulfonylcarbamoyl]pyridine-2-carboxylate

Systemtic Name: pentan-3-yl 5-[[4-[2-[(4-ethoxyphenyl)carbonylamino]ethyl]phenyl]sulfonylcarbamoyl]pyridine-2-carboxylate Openeye Name: 1-ethylpropyl 5-[[4-[2-[(4-ethoxybenzoyl)amino]ethyl]phenyl]sulfonylcarbamoyl]pyridine-2-carboxylate CAS Name: 5-[[[4-[2-[[(4-ethoxyphenyl)-oxomethyl]amino]ethyl]phenyl]sulfonylamino]-oxomethyl]-2-pyridinecarboxylic acid pentan-3-yl ester IUPAC Name: pentan-3-yl 5-[[4-[2-[(4-ethoxybenzoyl)amino]ethyl]phenyl]sulfonylcarbamoyl]pyridine-2-carboxylate Traditional Name: 5-[[4-[2-[(4-ethoxybenzoyl)amino]ethyl]phenyl]sulfonylcarbamoyl]picolinic acid 1-ethylpropyl ester Formula: C29H33N3O7S MolecularWeight: 567.65322

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)OC(=O)C1=NC=C(C=C1)C(=O)NS(=O)(=O)C2=CC=C(C=C2)CCNC(=O)C3=CC=C(C=C3)OCC

Isomeric SMILES

CCC(CC)OC(=O)C1=NC=C(C=C1)C(=O)NS(=O)(=O)C2=CC=C(C=C2)CCNC(=O)C3=CC=C(C=C3)OCC

InChI

InChI=1S/C29H33N3O7S/c1-4-23(5-2)39-29(35)26-16-11-22(19-31-26)28(34)32-40(36,37)25-14-7-20(8-15-25)17-18-30-27(33)21-9-12-24(13-10-21)38-6-3/h7-16,19,23H,4-6,17-18H2,1-3H3,(H,30,33)(H,32,34)