1-butyl-3-[[5-(dimethylsulfamoyl)-2-methyl-phenyl]carbamothioylamino]thiourea

Systemtic Name: 1-butyl-3-[[5-(dimethylsulfamoyl)-2-methyl-phenyl]carbamothioylamino]thiourea Openeye Name: 1-butyl-3-[[5-(dimethylsulfamoyl)-2-methyl-phenyl]carbamothioylamino]thiourea CAS Name: 1-butyl-3-[[[5-(dimethylsulfamoyl)-2-methylanilino]-sulfanylidenemethyl]amino]thiourea IUPAC Name: 1-butyl-3-[[5-(dimethylsulfamoyl)-2-methylphenyl]carbamothioylamino]thiourea Traditional Name: 1-butyl-3-[[5-(dimethylsulfamoyl)-2-methyl-phenyl]thiocarbamoylamino]thiourea Formula: C15H25N5O2S3 MolecularWeight: 403.5863

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)NNC(=S)NC1=C(C=CC(=C1)S(=O)(=O)N(C)C)C

Isomeric SMILES

CCCCNC(=S)NNC(=S)NC1=C(C=CC(=C1)S(=O)(=O)N(C)C)C

InChI

InChI=1S/C15H25N5O2S3/c1-5-6-9-16-14(23)18-19-15(24)17-13-10-12(8-7-11(13)2)25(21,22)20(3)4/h7-8,10H,5-6,9H2,1-4H3,(H2,16,18,23)(H2,17,19,24)