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

Systemtic Name: N-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-yl-phenyl)-2-phenylsulfanyl-ethanamide Openeye Name: N-(5-morpholinosulfonyl-2-pyrrolidin-1-yl-phenyl)-2-phenylsulfanyl-acetamide CAS Name: N-[5-(4-morpholinylsulfonyl)-2-(1-pyrrolidinyl)phenyl]-2-(phenylthio)acetamide IUPAC Name: N-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-ylphenyl)-2-phenylsulfanylacetamide Traditional Name: N-(5-morpholinosulfonyl-2-pyrrolidino-phenyl)-2-(phenylthio)acetamide Formula: C22H27N3O4S2 MolecularWeight: 461.59748

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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=C4

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)NC(=O)CSC4=CC=CC=C4

InChI

InChI=1S/C22H27N3O4S2/c26-22(17-30-18-6-2-1-3-7-18)23-20-16-19(8-9-21(20)24-10-4-5-11-24)31(27,28)25-12-14-29-15-13-25/h1-3,6-9,16H,4-5,10-15,17H2,(H,23,26)