1-(2-tert-butylphenyl)-3-[5-(diethylsulfamoyl)-2-methyl-phenyl]thiourea

Systemtic Name: 1-(2-tert-butylphenyl)-3-[5-(diethylsulfamoyl)-2-methyl-phenyl]thiourea Openeye Name: 1-(2-tert-butylphenyl)-3-[5-(diethylsulfamoyl)-2-methyl-phenyl]thiourea CAS Name: 1-(2-tert-butylphenyl)-3-[5-(diethylsulfamoyl)-2-methylphenyl]thiourea IUPAC Name: 1-(2-tert-butylphenyl)-3-[5-(diethylsulfamoyl)-2-methylphenyl]thiourea Traditional Name: 1-(2-tert-butylphenyl)-3-[5-(diethylsulfamoyl)-2-methyl-phenyl]thiourea Formula: C22H31N3O2S2 MolecularWeight: 433.63044

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)C)NC(=S)NC2=CC=CC=C2C(C)(C)C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)C)NC(=S)NC2=CC=CC=C2C(C)(C)C

InChI

InChI=1S/C22H31N3O2S2/c1-7-25(8-2)29(26,27)17-14-13-16(3)20(15-17)24-21(28)23-19-12-10-9-11-18(19)22(4,5)6/h9-15H,7-8H2,1-6H3,(H2,23,24,28)