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

Systemtic Name: 1-(3,4-dimethylphenyl)-3-[2-[(4-iodophenyl)sulfamoyl]-4-methyl-phenyl]thiourea Openeye Name: 1-(3,4-dimethylphenyl)-3-[2-[(4-iodophenyl)sulfamoyl]-4-methyl-phenyl]thiourea CAS Name: 1-(3,4-dimethylphenyl)-3-[2-[(4-iodophenyl)sulfamoyl]-4-methylphenyl]thiourea IUPAC Name: 1-(3,4-dimethylphenyl)-3-[2-[(4-iodophenyl)sulfamoyl]-4-methylphenyl]thiourea Traditional Name: 1-(3,4-dimethylphenyl)-3-[2-[(4-iodophenyl)sulfamoyl]-4-methyl-phenyl]thiourea Formula: C22H22IN3O2S2 MolecularWeight: 551.46345

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H22IN3O2S2/c1-14-4-11-20(25-22(29)24-19-8-5-15(2)16(3)13-19)21(12-14)30(27,28)26-18-9-6-17(23)7-10-18/h4-13,26H,1-3H3,(H2,24,25,29)