2-[(5-chloranylthiophen-2-yl)methylsulfanyl]-N-[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]ethanamide

Systemtic Name: 2-[(5-chloranylthiophen-2-yl)methylsulfanyl]-N-[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]ethanamide Openeye Name: 2-[(5-chloro-2-thienyl)methylsulfanyl]-N-[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]acetamide CAS Name: 2-[(5-chloro-2-thiophenyl)methylthio]-N-[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]acetamide IUPAC Name: 2-[(5-chlorothiophen-2-yl)methylsulfanyl]-N-[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]acetamide Traditional Name: 2-[(5-chloro-2-thienyl)methylthio]-N-[3-(1-pyrrolin-1-ium-2-ylsulfamoyl)phenyl]acetamide Formula: C17H19ClN3O3S3+ MolecularWeight: 444.99906

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=[NH+]C1)NS(=O)(=O)C2=CC=CC(=C2)NC(=O)CSCC3=CC=C(S3)Cl

Isomeric SMILES

C1CC(=[NH+]C1)NS(=O)(=O)C2=CC=CC(=C2)NC(=O)CSCC3=CC=C(S3)Cl

InChI

InChI=1S/C17H18ClN3O3S3/c18-15-7-6-13(26-15)10-25-11-17(22)20-12-3-1-4-14(9-12)27(23,24)21-16-5-2-8-19-16/h1,3-4,6-7,9H,2,5,8,10-11H2,(H,19,21)(H,20,22)/p+1