N-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-yl-phenyl)-2-pyridin-2-ylsulfanyl-ethanamide

Systemtic Name: N-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-yl-phenyl)-2-pyridin-2-ylsulfanyl-ethanamide Openeye Name: N-(5-morpholinosulfonyl-2-pyrrolidin-1-yl-phenyl)-2-(2-pyridylsulfanyl)acetamide CAS Name: N-[5-(4-morpholinylsulfonyl)-2-(1-pyrrolidinyl)phenyl]-2-(2-pyridinylthio)acetamide IUPAC Name: N-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-ylphenyl)-2-pyridin-2-ylsulfanylacetamide Traditional Name: N-(5-morpholinosulfonyl-2-pyrrolidino-phenyl)-2-(2-pyridylthio)acetamide Formula: C21H26N4O4S2 MolecularWeight: 462.58554

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)NC(=O)CSC4=CC=CC=N4

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)NC(=O)CSC4=CC=CC=N4

InChI

InChI=1S/C21H26N4O4S2/c26-20(16-30-21-5-1-2-8-22-21)23-18-15-17(6-7-19(18)24-9-3-4-10-24)31(27,28)25-11-13-29-14-12-25/h1-2,5-8,15H,3-4,9-14,16H2,(H,23,26)