N-[4-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]-5-methyl-pyrazine-2-carboxamide

Systemtic Name: N-[4-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]-5-methyl-pyrazine-2-carboxamide Openeye Name: N-[4-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]-5-methyl-pyrazine-2-carboxamide CAS Name: N-[4-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]-5-methyl-2-pyrazinecarboxamide IUPAC Name: N-[4-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]-5-methylpyrazine-2-carboxamide Traditional Name: 5-methyl-N-[4-(1-pyrrolin-1-ium-2-ylsulfamoyl)phenyl]pyrazinamide Formula: C16H18N5O3S+ MolecularWeight: 360.41082

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(N=C1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=[NH+]CCC3

Isomeric SMILES

CC1=NC=C(N=C1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=[NH+]CCC3

InChI

InChI=1S/C16H17N5O3S/c1-11-9-19-14(10-18-11)16(22)20-12-4-6-13(7-5-12)25(23,24)21-15-3-2-8-17-15/h4-7,9-10H,2-3,8H2,1H3,(H,17,21)(H,20,22)/p+1