1-[(5-bromanyl-2-phenylmethoxy-phenyl)methyl]-6-(ethylamino)-N-(2-hydroxyethylsulfonyl)-2H-pyridine-3-carboxamide

Systemtic Name: 1-[(5-bromanyl-2-phenylmethoxy-phenyl)methyl]-6-(ethylamino)-N-(2-hydroxyethylsulfonyl)-2H-pyridine-3-carboxamide Openeye Name: 1-[(2-benzyloxy-5-bromo-phenyl)methyl]-6-(ethylamino)-N-(2-hydroxyethylsulfonyl)-2H-pyridine-3-carboxamide CAS Name: 1-[(5-bromo-2-phenylmethoxyphenyl)methyl]-6-(ethylamino)-N-(2-hydroxyethylsulfonyl)-2H-pyridine-3-carboxamide IUPAC Name: 1-[(5-bromo-2-phenylmethoxyphenyl)methyl]-6-(ethylamino)-N-(2-hydroxyethylsulfonyl)-2H-pyridine-3-carboxamide Traditional Name: 1-(2-benzoxy-5-bromo-benzyl)-6-(ethylamino)-N-(2-hydroxyethylsulfonyl)-2H-pyridine-3-carboxamide Formula: C24H28BrN3O5S MolecularWeight: 550.46522

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=CC=C(CN1CC2=C(C=CC(=C2)Br)OCC3=CC=CC=C3)C(=O)NS(=O)(=O)CCO

Isomeric SMILES

CCNC1=CC=C(CN1CC2=C(C=CC(=C2)Br)OCC3=CC=CC=C3)C(=O)NS(=O)(=O)CCO

InChI

InChI=1S/C24H28BrN3O5S/c1-2-26-23-11-8-19(24(30)27-34(31,32)13-12-29)15-28(23)16-20-14-21(25)9-10-22(20)33-17-18-6-4-3-5-7-18/h3-11,14,26,29H,2,12-13,15-17H2,1H3,(H,27,30)