1-[3,5-bis(trifluoromethyl)phenyl]-3-(4-sulfamoylphenyl)thiourea

Systemtic Name: 1-[3,5-bis(trifluoromethyl)phenyl]-3-(4-sulfamoylphenyl)thiourea Openeye Name: 1-[3,5-bis(trifluoromethyl)phenyl]-3-(4-sulfamoylphenyl)thiourea CAS Name: 1-[3,5-bis(trifluoromethyl)phenyl]-3-(4-sulfamoylphenyl)thiourea IUPAC Name: 1-[3,5-bis(trifluoromethyl)phenyl]-3-(4-sulfamoylphenyl)thiourea Traditional Name: 1-[3,5-bis(trifluoromethyl)phenyl]-3-(4-sulfamoylphenyl)thiourea Formula: C15H11F6N3O2S2 MolecularWeight: 443.387159

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=S)NC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)S(=O)(=O)N

Isomeric SMILES

C1=CC(=CC=C1NC(=S)NC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)S(=O)(=O)N

InChI

InChI=1S/C15H11F6N3O2S2/c16-14(17,18)8-5-9(15(19,20)21)7-11(6-8)24-13(27)23-10-1-3-12(4-2-10)28(22,25)26/h1-7H,(H2,22,25,26)(H2,23,24,27)