4-[4-cyano-5-(3-morpholin-4-ylpropylamino)-1,3-oxazol-2-yl]-N,N-diethyl-benzenesulfonamide

Systemtic Name: 4-[4-cyano-5-(3-morpholin-4-ylpropylamino)-1,3-oxazol-2-yl]-N,N-diethyl-benzenesulfonamide Openeye Name: 4-[4-cyano-5-(3-morpholinopropylamino)oxazol-2-yl]-N,N-diethyl-benzenesulfonamide CAS Name: 4-[4-cyano-5-[3-(4-morpholinyl)propylamino]-2-oxazolyl]-N,N-diethylbenzenesulfonamide IUPAC Name: 4-[4-cyano-5-(3-morpholin-4-ylpropylamino)-1,3-oxazol-2-yl]-N,N-diethylbenzenesulfonamide Traditional Name: 4-[4-cyano-5-(3-morpholinopropylamino)oxazol-2-yl]-N,N-diethyl-benzenesulfonamide Formula: C21H29N5O4S MolecularWeight: 447.55106

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)C2=NC(=C(O2)NCCCN3CCOCC3)C#N

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)C2=NC(=C(O2)NCCCN3CCOCC3)C#N

InChI

InChI=1S/C21H29N5O4S/c1-3-26(4-2)31(27,28)18-8-6-17(7-9-18)20-24-19(16-22)21(30-20)23-10-5-11-25-12-14-29-15-13-25/h6-9,23H,3-5,10-15H2,1-2H3