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

Systemtic Name: 1-[4-[(2,6-dimethylpyrimidin-4-yl)sulfamoyl]phenyl]-3-(4-propan-2-ylphenyl)thiourea Openeye Name: 1-[4-[(2,6-dimethylpyrimidin-4-yl)sulfamoyl]phenyl]-3-(4-isopropylphenyl)thiourea CAS Name: 1-[4-[(2,6-dimethyl-4-pyrimidinyl)sulfamoyl]phenyl]-3-(4-propan-2-ylphenyl)thiourea IUPAC Name: 1-[4-[(2,6-dimethylpyrimidin-4-yl)sulfamoyl]phenyl]-3-(4-propan-2-ylphenyl)thiourea Traditional Name: 1-[4-[(2,6-dimethylpyrimidin-4-yl)sulfamoyl]phenyl]-3-p-cumenyl-thiourea Formula: C22H25N5O2S2 MolecularWeight: 455.5962

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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)C(C)C

Isomeric SMILES

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

InChI

InChI=1S/C22H25N5O2S2/c1-14(2)17-5-7-18(8-6-17)25-22(30)26-19-9-11-20(12-10-19)31(28,29)27-21-13-15(3)23-16(4)24-21/h5-14H,1-4H3,(H,23,24,27)(H2,25,26,30)