1-[(E)-[5-[2-nitro-4-(trifluoromethyl)phenyl]furan-2-yl]methylideneamino]thiourea

Systemtic Name: 1-[(E)-[5-[2-nitro-4-(trifluoromethyl)phenyl]furan-2-yl]methylideneamino]thiourea Openeye Name: [(E)-[5-[2-nitro-4-(trifluoromethyl)phenyl]-2-furyl]methyleneamino]thiourea CAS Name: [(E)-[5-[2-nitro-4-(trifluoromethyl)phenyl]-2-furanyl]methylideneamino]thiourea IUPAC Name: [(E)-[5-[2-nitro-4-(trifluoromethyl)phenyl]furan-2-yl]methylideneamino]thiourea Traditional Name: [(E)-[5-[2-nitro-4-(trifluoromethyl)phenyl]-2-furyl]methyleneamino]thiourea Formula: C13H9F3N4O3S MolecularWeight: 358.29577

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(F)(F)F)[N+](=O)[O-])C2=CC=C(O2)C=NNC(=S)N

Isomeric SMILES

C1=CC(=C(C=C1C(F)(F)F)[N+](=O)[O-])C2=CC=C(O2)/C=N/NC(=S)N

InChI

InChI=1S/C13H9F3N4O3S/c14-13(15,16)7-1-3-9(10(5-7)20(21)22)11-4-2-8(23-11)6-18-19-12(17)24/h1-6H,(H3,17,19,24)/b18-6+