1-[2-chloranyl-5-(trifluoromethyl)phenyl]-3-[(4-sulfamoylphenyl)carbonylamino]thiourea

Systemtic Name: 1-[2-chloranyl-5-(trifluoromethyl)phenyl]-3-[(4-sulfamoylphenyl)carbonylamino]thiourea Openeye Name: 1-[2-chloro-5-(trifluoromethyl)phenyl]-3-[(4-sulfamoylbenzoyl)amino]thiourea CAS Name: 1-[2-chloro-5-(trifluoromethyl)phenyl]-3-[[oxo-(4-sulfamoylphenyl)methyl]amino]thiourea IUPAC Name: 1-[2-chloro-5-(trifluoromethyl)phenyl]-3-[(4-sulfamoylbenzoyl)amino]thiourea Traditional Name: 1-[2-chloro-5-(trifluoromethyl)phenyl]-3-[(4-sulfamoylbenzoyl)amino]thiourea Formula: C15H12ClF3N4O3S2 MolecularWeight: 452.85899

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NNC(=S)NC2=C(C=CC(=C2)C(F)(F)F)Cl)S(=O)(=O)N

Isomeric SMILES

C1=CC(=CC=C1C(=O)NNC(=S)NC2=C(C=CC(=C2)C(F)(F)F)Cl)S(=O)(=O)N

InChI

InChI=1S/C15H12ClF3N4O3S2/c16-11-6-3-9(15(17,18)19)7-12(11)21-14(27)23-22-13(24)8-1-4-10(5-2-8)28(20,25)26/h1-7H,(H,22,24)(H2,20,25,26)(H2,21,23,27)