6-(ethylamino)-1-[(5-methylsulfonyl-2-phenylmethoxy-phenyl)methyl]-N-(phenylmethyl)sulfonyl-2H-pyridine-3-carboxamide

Systemtic Name: 6-(ethylamino)-1-[(5-methylsulfonyl-2-phenylmethoxy-phenyl)methyl]-N-(phenylmethyl)sulfonyl-2H-pyridine-3-carboxamide Openeye Name: 1-[(2-benzyloxy-5-methylsulfonyl-phenyl)methyl]-N-benzylsulfonyl-6-(ethylamino)-2H-pyridine-3-carboxamide CAS Name: 6-(ethylamino)-1-[(5-methylsulfonyl-2-phenylmethoxyphenyl)methyl]-N-(phenylmethyl)sulfonyl-2H-pyridine-3-carboxamide IUPAC Name: N-benzylsulfonyl-6-(ethylamino)-1-[(5-methylsulfonyl-2-phenylmethoxyphenyl)methyl]-2H-pyridine-3-carboxamide Traditional Name: 1-(2-benzoxy-5-mesyl-benzyl)-N-benzylsulfonyl-6-(ethylamino)-2H-pyridine-3-carboxamide Formula: C30H33N3O6S2 MolecularWeight: 595.72952

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=CC=C(CN1CC2=C(C=CC(=C2)S(=O)(=O)C)OCC3=CC=CC=C3)C(=O)NS(=O)(=O)CC4=CC=CC=C4

Isomeric SMILES

CCNC1=CC=C(CN1CC2=C(C=CC(=C2)S(=O)(=O)C)OCC3=CC=CC=C3)C(=O)NS(=O)(=O)CC4=CC=CC=C4

InChI

InChI=1S/C30H33N3O6S2/c1-3-31-29-17-14-25(30(34)32-41(37,38)22-24-12-8-5-9-13-24)19-33(29)20-26-18-27(40(2,35)36)15-16-28(26)39-21-23-10-6-4-7-11-23/h4-18,31H,3,19-22H2,1-2H3,(H,32,34)