1-(2,3-dimethyl-5-sulfamoyl-phenyl)-3-(3-methylsulfanylpropyl)thiourea

Systemtic Name: 1-(2,3-dimethyl-5-sulfamoyl-phenyl)-3-(3-methylsulfanylpropyl)thiourea Openeye Name: 1-(2,3-dimethyl-5-sulfamoyl-phenyl)-3-(3-methylsulfanylpropyl)thiourea CAS Name: 1-(2,3-dimethyl-5-sulfamoylphenyl)-3-[3-(methylthio)propyl]thiourea IUPAC Name: 1-(2,3-dimethyl-5-sulfamoylphenyl)-3-(3-methylsulfanylpropyl)thiourea Traditional Name: 1-(2,3-dimethyl-5-sulfamoyl-phenyl)-3-[3-(methylthio)propyl]thiourea Formula: C13H21N3O2S3 MolecularWeight: 347.51974

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1C)NC(=S)NCCCSC)S(=O)(=O)N

Isomeric SMILES

CC1=CC(=CC(=C1C)NC(=S)NCCCSC)S(=O)(=O)N

InChI

InChI=1S/C13H21N3O2S3/c1-9-7-11(21(14,17)18)8-12(10(9)2)16-13(19)15-5-4-6-20-3/h7-8H,4-6H2,1-3H3,(H2,14,17,18)(H2,15,16,19)