6-[(5-bromanyl-2-phenylmethoxy-phenyl)methyl-ethyl-amino]-N-(2-hydroxyethylsulfonyl)pyridine-3-carboxamide

Systemtic Name: 6-[(5-bromanyl-2-phenylmethoxy-phenyl)methyl-ethyl-amino]-N-(2-hydroxyethylsulfonyl)pyridine-3-carboxamide Openeye Name: 6-[(2-benzyloxy-5-bromo-phenyl)methyl-ethyl-amino]-N-(2-hydroxyethylsulfonyl)pyridine-3-carboxamide CAS Name: 6-[(5-bromo-2-phenylmethoxyphenyl)methyl-ethylamino]-N-(2-hydroxyethylsulfonyl)-3-pyridinecarboxamide IUPAC Name: 6-[(5-bromo-2-phenylmethoxyphenyl)methyl-ethylamino]-N-(2-hydroxyethylsulfonyl)pyridine-3-carboxamide Traditional Name: 6-[(2-benzoxy-5-bromo-benzyl)-ethyl-amino]-N-(2-hydroxyethylsulfonyl)nicotinamide Formula: C24H26BrN3O5S MolecularWeight: 548.44934

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=C(C=CC(=C1)Br)OCC2=CC=CC=C2)C3=NC=C(C=C3)C(=O)NS(=O)(=O)CCO

Isomeric SMILES

CCN(CC1=C(C=CC(=C1)Br)OCC2=CC=CC=C2)C3=NC=C(C=C3)C(=O)NS(=O)(=O)CCO

InChI

InChI=1S/C24H26BrN3O5S/c1-2-28(23-11-8-19(15-26-23)24(30)27-34(31,32)13-12-29)16-20-14-21(25)9-10-22(20)33-17-18-6-4-3-5-7-18/h3-11,14-15,29H,2,12-13,16-17H2,1H3,(H,27,30)