1-[2-chloranyl-5-(trifluoromethyl)phenyl]-3-[(E)-thiolan-3-ylideneamino]thiourea

Systemtic Name: 1-[2-chloranyl-5-(trifluoromethyl)phenyl]-3-[(E)-thiolan-3-ylideneamino]thiourea Openeye Name: 1-[2-chloro-5-(trifluoromethyl)phenyl]-3-[(E)-tetrahydrothiophen-3-ylideneamino]thiourea CAS Name: 1-[2-chloro-5-(trifluoromethyl)phenyl]-3-[(E)-3-thiolanylideneamino]thiourea IUPAC Name: 1-[2-chloro-5-(trifluoromethyl)phenyl]-3-[(E)-thiolan-3-ylideneamino]thiourea Traditional Name: 1-[2-chloro-5-(trifluoromethyl)phenyl]-3-[(E)-tetrahydrothiophen-3-ylideneamino]thiourea Formula: C12H11ClF3N3S2 MolecularWeight: 353.81405

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Descriptors Computed from Structure

Canonical SMILES:

C1CSCC1=NNC(=S)NC2=C(C=CC(=C2)C(F)(F)F)Cl

Isomeric SMILES

C\1CSC/C1=N/NC(=S)NC2=C(C=CC(=C2)C(F)(F)F)Cl

InChI

InChI=1S/C12H11ClF3N3S2/c13-9-2-1-7(12(14,15)16)5-10(9)17-11(20)19-18-8-3-4-21-6-8/h1-2,5H,3-4,6H2,(H2,17,19,20)/b18-8+