1-[5-[(4-chlorophenyl)sulfamoyl]-2-methyl-phenyl]-3-(2,5-dimethylphenyl)thiourea

Systemtic Name: 1-[5-[(4-chlorophenyl)sulfamoyl]-2-methyl-phenyl]-3-(2,5-dimethylphenyl)thiourea Openeye Name: 1-[5-[(4-chlorophenyl)sulfamoyl]-2-methyl-phenyl]-3-(2,5-dimethylphenyl)thiourea CAS Name: 1-[5-[(4-chlorophenyl)sulfamoyl]-2-methylphenyl]-3-(2,5-dimethylphenyl)thiourea IUPAC Name: 1-[5-[(4-chlorophenyl)sulfamoyl]-2-methylphenyl]-3-(2,5-dimethylphenyl)thiourea Traditional Name: 1-[5-[(4-chlorophenyl)sulfamoyl]-2-methyl-phenyl]-3-(2,5-dimethylphenyl)thiourea Formula: C22H22ClN3O2S2 MolecularWeight: 460.01198

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=S)NC2=C(C=CC(=C2)S(=O)(=O)NC3=CC=C(C=C3)Cl)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=S)NC2=C(C=CC(=C2)S(=O)(=O)NC3=CC=C(C=C3)Cl)C

InChI

InChI=1S/C22H22ClN3O2S2/c1-14-4-5-15(2)20(12-14)24-22(29)25-21-13-19(11-6-16(21)3)30(27,28)26-18-9-7-17(23)8-10-18/h4-13,26H,1-3H3,(H2,24,25,29)