N-(4-methoxy-3-morpholin-4-ylsulfonyl-phenyl)-2-pyridin-4-ylsulfanyl-ethanamide

Systemtic Name: N-(4-methoxy-3-morpholin-4-ylsulfonyl-phenyl)-2-pyridin-4-ylsulfanyl-ethanamide Openeye Name: N-(4-methoxy-3-morpholinosulfonyl-phenyl)-2-(4-pyridylsulfanyl)acetamide CAS Name: N-[4-methoxy-3-(4-morpholinylsulfonyl)phenyl]-2-(pyridin-4-ylthio)acetamide IUPAC Name: N-(4-methoxy-3-morpholin-4-ylsulfonylphenyl)-2-pyridin-4-ylsulfanylacetamide Traditional Name: N-(4-methoxy-3-morpholinosulfonyl-phenyl)-2-(4-pyridylthio)acetamide Formula: C18H21N3O5S2 MolecularWeight: 423.50644

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)CSC2=CC=NC=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)CSC2=CC=NC=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C18H21N3O5S2/c1-25-16-3-2-14(20-18(22)13-27-15-4-6-19-7-5-15)12-17(16)28(23,24)21-8-10-26-11-9-21/h2-7,12H,8-11,13H2,1H3,(H,20,22)