1-[4-(pyrimidin-2-ylsulfamoyl)phenyl]-3-(4-pyrrolidin-1-ylcarbonylphenyl)thiourea

Systemtic Name: 1-[4-(pyrimidin-2-ylsulfamoyl)phenyl]-3-(4-pyrrolidin-1-ylcarbonylphenyl)thiourea Openeye Name: 1-[4-(pyrimidin-2-ylsulfamoyl)phenyl]-3-[4-(pyrrolidine-1-carbonyl)phenyl]thiourea CAS Name: 1-[4-[oxo(1-pyrrolidinyl)methyl]phenyl]-3-[4-(2-pyrimidinylsulfamoyl)phenyl]thiourea IUPAC Name: 1-[4-(pyrimidin-2-ylsulfamoyl)phenyl]-3-[4-(pyrrolidine-1-carbonyl)phenyl]thiourea Traditional Name: 1-[4-(2-pyrimidylsulfamoyl)phenyl]-3-[4-(pyrrolidine-1-carbonyl)phenyl]thiourea Formula: C22H22N6O3S2 MolecularWeight: 482.57848

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2=CC=C(C=C2)NC(=S)NC3=CC=C(C=C3)S(=O)(=O)NC4=NC=CC=N4

Isomeric SMILES

C1CCN(C1)C(=O)C2=CC=C(C=C2)NC(=S)NC3=CC=C(C=C3)S(=O)(=O)NC4=NC=CC=N4

InChI

InChI=1S/C22H22N6O3S2/c29-20(28-14-1-2-15-28)16-4-6-17(7-5-16)25-22(32)26-18-8-10-19(11-9-18)33(30,31)27-21-23-12-3-13-24-21/h3-13H,1-2,14-15H2,(H,23,24,27)(H2,25,26,32)