2-[[4-(4-cyano-3-methoxy-5-phenethyloxy-phenyl)phenyl]methylsulfonyl]-N-(2-hydroxyethyl)ethanamide

Systemtic Name: 2-[[4-(4-cyano-3-methoxy-5-phenethyloxy-phenyl)phenyl]methylsulfonyl]-N-(2-hydroxyethyl)ethanamide Openeye Name: 2-[[4-(4-cyano-3-methoxy-5-phenethyloxy-phenyl)phenyl]methylsulfonyl]-N-(2-hydroxyethyl)acetamide CAS Name: 2-[[4-(4-cyano-3-methoxy-5-phenethyloxyphenyl)phenyl]methylsulfonyl]-N-(2-hydroxyethyl)acetamide IUPAC Name: 2-[[4-(4-cyano-3-methoxy-5-phenethyloxyphenyl)phenyl]methylsulfonyl]-N-(2-hydroxyethyl)acetamide Traditional Name: 2-[4-(4-cyano-3-methoxy-5-phenethyloxy-phenyl)benzyl]sulfonyl-N-(2-hydroxyethyl)acetamide Formula: C27H28N2O6S MolecularWeight: 508.58602

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C2=CC=C(C=C2)CS(=O)(=O)CC(=O)NCCO)OCCC3=CC=CC=C3)C#N

Isomeric SMILES

COC1=C(C(=CC(=C1)C2=CC=C(C=C2)CS(=O)(=O)CC(=O)NCCO)OCCC3=CC=CC=C3)C#N

InChI

InChI=1S/C27H28N2O6S/c1-34-25-15-23(16-26(24(25)17-28)35-14-11-20-5-3-2-4-6-20)22-9-7-21(8-10-22)18-36(32,33)19-27(31)29-12-13-30/h2-10,15-16,30H,11-14,18-19H2,1H3,(H,29,31)