4-[4-cyano-5-(2-morpholin-4-ium-4-ylethylamino)-1,3-oxazol-2-yl]-N-methyl-N-(phenylmethyl)benzenesulfonamide

Systemtic Name: 4-[4-cyano-5-(2-morpholin-4-ium-4-ylethylamino)-1,3-oxazol-2-yl]-N-methyl-N-(phenylmethyl)benzenesulfonamide Openeye Name: N-benzyl-4-[4-cyano-5-(2-morpholin-4-ium-4-ylethylamino)oxazol-2-yl]-N-methyl-benzenesulfonamide CAS Name: 4-[4-cyano-5-[2-(4-morpholin-4-iumyl)ethylamino]-2-oxazolyl]-N-methyl-N-(phenylmethyl)benzenesulfonamide IUPAC Name: N-benzyl-4-[4-cyano-5-(2-morpholin-4-ium-4-ylethylamino)-1,3-oxazol-2-yl]-N-methylbenzenesulfonamide Traditional Name: N-benzyl-4-[4-cyano-5-(2-morpholin-4-ium-4-ylethylamino)oxazol-2-yl]-N-methyl-benzenesulfonamide Formula: C24H28N5O4S+ MolecularWeight: 482.57522

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)C3=NC(=C(O3)NCC[NH+]4CCOCC4)C#N

Isomeric SMILES

CN(CC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)C3=NC(=C(O3)NCC[NH+]4CCOCC4)C#N

InChI

InChI=1S/C24H27N5O4S/c1-28(18-19-5-3-2-4-6-19)34(30,31)21-9-7-20(8-10-21)23-27-22(17-25)24(33-23)26-11-12-29-13-15-32-16-14-29/h2-10,26H,11-16,18H2,1H3/p+1