(phenylmethyl) 5-[[4-(2-benzamidoethyl)phenyl]sulfonylcarbamoyl]pyridine-2-carboxylate

Systemtic Name: (phenylmethyl) 5-[[4-(2-benzamidoethyl)phenyl]sulfonylcarbamoyl]pyridine-2-carboxylate Openeye Name: benzyl 5-[[4-(2-benzamidoethyl)phenyl]sulfonylcarbamoyl]pyridine-2-carboxylate CAS Name: 5-[[[4-(2-benzamidoethyl)phenyl]sulfonylamino]-oxomethyl]-2-pyridinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 5-[[4-(2-benzamidoethyl)phenyl]sulfonylcarbamoyl]pyridine-2-carboxylate Traditional Name: 5-[[4-(2-benzamidoethyl)phenyl]sulfonylcarbamoyl]picolinic acid benzyl ester Formula: C29H25N3O6S MolecularWeight: 543.5903

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)C2=NC=C(C=C2)C(=O)NS(=O)(=O)C3=CC=C(C=C3)CCNC(=O)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)C2=NC=C(C=C2)C(=O)NS(=O)(=O)C3=CC=C(C=C3)CCNC(=O)C4=CC=CC=C4

InChI

InChI=1S/C29H25N3O6S/c33-27(23-9-5-2-6-10-23)30-18-17-21-11-14-25(15-12-21)39(36,37)32-28(34)24-13-16-26(31-19-24)29(35)38-20-22-7-3-1-4-8-22/h1-16,19H,17-18,20H2,(H,30,33)(H,32,34)