4-ethyl-3-morpholin-4-ylsulfonyl-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]benzamide

Systemtic Name: 4-ethyl-3-morpholin-4-ylsulfonyl-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]benzamide Openeye Name: 4-ethyl-3-morpholinosulfonyl-N-[4-(3-pyridylmethylsulfanyl)phenyl]benzamide CAS Name: 4-ethyl-3-(4-morpholinylsulfonyl)-N-[4-(3-pyridinylmethylthio)phenyl]benzamide IUPAC Name: 4-ethyl-3-morpholin-4-ylsulfonyl-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]benzamide Traditional Name: 4-ethyl-3-morpholinosulfonyl-N-[4-(3-pyridylmethylthio)phenyl]benzamide Formula: C25H27N3O4S2 MolecularWeight: 497.62958

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)SCC3=CN=CC=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CCC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)SCC3=CN=CC=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C25H27N3O4S2/c1-2-20-5-6-21(16-24(20)34(30,31)28-12-14-32-15-13-28)25(29)27-22-7-9-23(10-8-22)33-18-19-4-3-11-26-17-19/h3-11,16-17H,2,12-15,18H2,1H3,(H,27,29)