1-[3,5-bis(trifluoromethyl)phenyl]-3-(3-chloranyl-4-methylsulfanyl-phenyl)urea

Systemtic Name: 1-[3,5-bis(trifluoromethyl)phenyl]-3-(3-chloranyl-4-methylsulfanyl-phenyl)urea Openeye Name: 1-[3,5-bis(trifluoromethyl)phenyl]-3-(3-chloro-4-methylsulfanyl-phenyl)urea CAS Name: 1-[3,5-bis(trifluoromethyl)phenyl]-3-[3-chloro-4-(methylthio)phenyl]urea IUPAC Name: 1-[3,5-bis(trifluoromethyl)phenyl]-3-(3-chloro-4-methylsulfanylphenyl)urea Traditional Name: 1-[3,5-bis(trifluoromethyl)phenyl]-3-[3-chloro-4-(methylthio)phenyl]urea Formula: C16H11ClF6N2OS MolecularWeight: 428.779759

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=C(C=C1)NC(=O)NC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)Cl

Isomeric SMILES

CSC1=C(C=C(C=C1)NC(=O)NC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)Cl

InChI

InChI=1S/C16H11ClF6N2OS/c1-27-13-3-2-10(7-12(13)17)24-14(26)25-11-5-8(15(18,19)20)4-9(6-11)16(21,22)23/h2-7H,1H3,(H2,24,25,26)