1-[1-(4-propan-2-ylphenyl)ethyl]-3-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiourea

Systemtic Name: 1-[1-(4-propan-2-ylphenyl)ethyl]-3-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiourea Openeye Name: 1-[1-(4-isopropylphenyl)ethyl]-3-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiourea CAS Name: 1-[1-(4-propan-2-ylphenyl)ethyl]-3-[4-(2-pyrimidinylsulfamoyl)phenyl]thiourea IUPAC Name: 1-[1-(4-propan-2-ylphenyl)ethyl]-3-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiourea Traditional Name: 1-(1-p-cumenylethyl)-3-[4-(2-pyrimidylsulfamoyl)phenyl]thiourea Formula: C22H25N5O2S2 MolecularWeight: 455.5962

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C(C)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CC=N3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C(C)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CC=N3

InChI

InChI=1S/C22H25N5O2S2/c1-15(2)17-5-7-18(8-6-17)16(3)25-22(30)26-19-9-11-20(12-10-19)31(28,29)27-21-23-13-4-14-24-21/h4-16H,1-3H3,(H,23,24,27)(H2,25,26,30)