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

Systemtic Name: N-[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]-3-methyl-thiophene-2-carboxamide Openeye Name: N-[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]-3-methyl-thiophene-2-carboxamide CAS Name: N-[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]-3-methyl-2-thiophenecarboxamide IUPAC Name: N-[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]-3-methylthiophene-2-carboxamide Traditional Name: 3-methyl-N-[3-(1-pyrrolin-1-ium-2-ylsulfamoyl)phenyl]thiophene-2-carboxamide Formula: C16H18N3O3S2+ MolecularWeight: 364.46242

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17N3O3S2/c1-11-7-9-23-15(11)16(20)18-12-4-2-5-13(10-12)24(21,22)19-14-6-3-8-17-14/h2,4-5,7,9-10H,3,6,8H2,1H3,(H,17,19)(H,18,20)/p+1