1-(2-chloranyl-4,6-dimethyl-phenyl)-3-[5-(diethylsulfamoyl)-2-pyrrolidin-1-yl-phenyl]thiourea

Systemtic Name: 1-(2-chloranyl-4,6-dimethyl-phenyl)-3-[5-(diethylsulfamoyl)-2-pyrrolidin-1-yl-phenyl]thiourea Openeye Name: 1-(2-chloro-4,6-dimethyl-phenyl)-3-[5-(diethylsulfamoyl)-2-pyrrolidin-1-yl-phenyl]thiourea CAS Name: 1-(2-chloro-4,6-dimethylphenyl)-3-[5-(diethylsulfamoyl)-2-(1-pyrrolidinyl)phenyl]thiourea IUPAC Name: 1-(2-chloro-4,6-dimethylphenyl)-3-[5-(diethylsulfamoyl)-2-pyrrolidin-1-ylphenyl]thiourea Traditional Name: 1-(2-chloro-4,6-dimethyl-phenyl)-3-[5-(diethylsulfamoyl)-2-pyrrolidino-phenyl]thiourea Formula: C23H31ClN4O2S2 MolecularWeight: 495.10084

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N2CCCC2)NC(=S)NC3=C(C=C(C=C3Cl)C)C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N2CCCC2)NC(=S)NC3=C(C=C(C=C3Cl)C)C

InChI

InChI=1S/C23H31ClN4O2S2/c1-5-28(6-2)32(29,30)18-9-10-21(27-11-7-8-12-27)20(15-18)25-23(31)26-22-17(4)13-16(3)14-19(22)24/h9-10,13-15H,5-8,11-12H2,1-4H3,(H2,25,26,31)