1-[4-[(2,6-dimethylpyrimidin-4-yl)sulfamoyl]phenyl]-3-(4-phenoxyphenyl)thiourea

Systemtic Name: 1-[4-[(2,6-dimethylpyrimidin-4-yl)sulfamoyl]phenyl]-3-(4-phenoxyphenyl)thiourea Openeye Name: 1-[4-[(2,6-dimethylpyrimidin-4-yl)sulfamoyl]phenyl]-3-(4-phenoxyphenyl)thiourea CAS Name: 1-[4-[(2,6-dimethyl-4-pyrimidinyl)sulfamoyl]phenyl]-3-(4-phenoxyphenyl)thiourea IUPAC Name: 1-[4-[(2,6-dimethylpyrimidin-4-yl)sulfamoyl]phenyl]-3-(4-phenoxyphenyl)thiourea Traditional Name: 1-[4-[(2,6-dimethylpyrimidin-4-yl)sulfamoyl]phenyl]-3-(4-phenoxyphenyl)thiourea Formula: C25H23N5O3S2 MolecularWeight: 505.61182

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)C)NS(=O)(=O)C2=CC=C(C=C2)NC(=S)NC3=CC=C(C=C3)OC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=NC(=N1)C)NS(=O)(=O)C2=CC=C(C=C2)NC(=S)NC3=CC=C(C=C3)OC4=CC=CC=C4

InChI

InChI=1S/C25H23N5O3S2/c1-17-16-24(27-18(2)26-17)30-35(31,32)23-14-10-20(11-15-23)29-25(34)28-19-8-12-22(13-9-19)33-21-6-4-3-5-7-21/h3-16H,1-2H3,(H,26,27,30)(H2,28,29,34)