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

Systemtic Name: 1-[3-(3,4-dihydro-2H-pyrrol-5-ylsulfamoyl)phenyl]-3-(2-morpholin-4-ylethyl)thiourea Openeye Name: 1-[3-(3,4-dihydro-2H-pyrrol-5-ylsulfamoyl)phenyl]-3-(2-morpholinoethyl)thiourea CAS Name: 1-[3-(3,4-dihydro-2H-pyrrol-5-ylsulfamoyl)phenyl]-3-[2-(4-morpholinyl)ethyl]thiourea IUPAC Name: 1-[3-(3,4-dihydro-2H-pyrrol-5-ylsulfamoyl)phenyl]-3-(2-morpholin-4-ylethyl)thiourea Traditional Name: 1-(2-morpholinoethyl)-3-[3-(1-pyrrolin-2-ylsulfamoyl)phenyl]thiourea Formula: C17H25N5O3S2 MolecularWeight: 411.5421

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(=NC1)NS(=O)(=O)C2=CC=CC(=C2)NC(=S)NCCN3CCOCC3

Isomeric SMILES

C1CC(=NC1)NS(=O)(=O)C2=CC=CC(=C2)NC(=S)NCCN3CCOCC3

InChI

InChI=1S/C17H25N5O3S2/c23-27(24,21-16-5-2-6-18-16)15-4-1-3-14(13-15)20-17(26)19-7-8-22-9-11-25-12-10-22/h1,3-4,13H,2,5-12H2,(H,18,21)(H2,19,20,26)