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

Systemtic Name: 1-[2-chloranyl-5-(trifluoromethyl)phenyl]-3-[(4-methylsulfonylphenyl)carbonylamino]thiourea Openeye Name: 1-[2-chloro-5-(trifluoromethyl)phenyl]-3-[(4-methylsulfonylbenzoyl)amino]thiourea CAS Name: 1-[2-chloro-5-(trifluoromethyl)phenyl]-3-[[(4-methylsulfonylphenyl)-oxomethyl]amino]thiourea IUPAC Name: 1-[2-chloro-5-(trifluoromethyl)phenyl]-3-[(4-methylsulfonylbenzoyl)amino]thiourea Traditional Name: 1-[2-chloro-5-(trifluoromethyl)phenyl]-3-[(4-mesylbenzoyl)amino]thiourea Formula: C16H13ClF3N3O3S2 MolecularWeight: 451.87093

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13ClF3N3O3S2/c1-28(25,26)11-5-2-9(3-6-11)14(24)22-23-15(27)21-13-8-10(16(18,19)20)4-7-12(13)17/h2-8H,1H3,(H,22,24)(H2,21,23,27)