(2S)-2-[(5-morpholin-4-ylsulfonylpyridin-1-ium-2-yl)amino]-N-propyl-propanamide

Systemtic Name: (2S)-2-[(5-morpholin-4-ylsulfonylpyridin-1-ium-2-yl)amino]-N-propyl-propanamide Openeye Name: (2S)-2-[(5-morpholinosulfonylpyridin-1-ium-2-yl)amino]-N-propyl-propanamide CAS Name: (2S)-2-[[5-(4-morpholinylsulfonyl)-2-pyridin-1-iumyl]amino]-N-propylpropanamide IUPAC Name: (2S)-2-[(5-morpholin-4-ylsulfonylpyridin-1-ium-2-yl)amino]-N-propylpropanamide Traditional Name: (2S)-2-[(5-morpholinosulfonylpyridin-1-ium-2-yl)amino]-N-propyl-propionamide Formula: C15H25N4O4S+ MolecularWeight: 357.4484

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)NC1=[NH+]C=C(C=C1)S(=O)(=O)N2CCOCC2

Isomeric SMILES

CCCNC(=O)[C@H](C)NC1=[NH+]C=C(C=C1)S(=O)(=O)N2CCOCC2

InChI

InChI=1S/C15H24N4O4S/c1-3-6-16-15(20)12(2)18-14-5-4-13(11-17-14)24(21,22)19-7-9-23-10-8-19/h4-5,11-12H,3,6-10H2,1-2H3,(H,16,20)(H,17,18)/p+1/t12-/m0/s1