1-cyclopropyl-3-[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]thiourea

Systemtic Name: 1-cyclopropyl-3-[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]thiourea Openeye Name: 1-cyclopropyl-3-[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]thiourea CAS Name: 1-cyclopropyl-3-[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]thiourea IUPAC Name: 1-cyclopropyl-3-[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]thiourea Traditional Name: 1-cyclopropyl-3-[3-(1-pyrrolin-1-ium-2-ylsulfamoyl)phenyl]thiourea Formula: C14H19N4O2S2+ MolecularWeight: 339.45626

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=[NH+]C1)NS(=O)(=O)C2=CC=CC(=C2)NC(=S)NC3CC3

Isomeric SMILES

C1CC(=[NH+]C1)NS(=O)(=O)C2=CC=CC(=C2)NC(=S)NC3CC3

InChI

InChI=1S/C14H18N4O2S2/c19-22(20,18-13-5-2-8-15-13)12-4-1-3-11(9-12)17-14(21)16-10-6-7-10/h1,3-4,9-10H,2,5-8H2,(H,15,18)(H2,16,17,21)/p+1