5-(cyclopropylsulfamoyl)-2-methyl-N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]benzamide

Systemtic Name: 5-(cyclopropylsulfamoyl)-2-methyl-N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]benzamide Openeye Name: 5-(cyclopropylsulfamoyl)-2-methyl-N-[(6-morpholinopyridin-1-ium-3-yl)methyl]benzamide CAS Name: 5-(cyclopropylsulfamoyl)-2-methyl-N-[[6-(4-morpholinyl)-3-pyridin-1-iumyl]methyl]benzamide IUPAC Name: 5-(cyclopropylsulfamoyl)-2-methyl-N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]benzamide Traditional Name: 5-(cyclopropylsulfamoyl)-2-methyl-N-[(6-morpholinopyridin-1-ium-3-yl)methyl]benzamide Formula: C21H27N4O4S+ MolecularWeight: 431.52848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NC2CC2)C(=O)NCC3=C[NH+]=C(C=C3)N4CCOCC4

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NC2CC2)C(=O)NCC3=C[NH+]=C(C=C3)N4CCOCC4

InChI

InChI=1S/C21H26N4O4S/c1-15-2-6-18(30(27,28)24-17-4-5-17)12-19(15)21(26)23-14-16-3-7-20(22-13-16)25-8-10-29-11-9-25/h2-3,6-7,12-13,17,24H,4-5,8-11,14H2,1H3,(H,23,26)/p+1