1-[4-nitro-2-(trifluoromethyl)phenyl]-3-(oxolan-2-ylmethyl)thiourea

Systemtic Name: 1-[4-nitro-2-(trifluoromethyl)phenyl]-3-(oxolan-2-ylmethyl)thiourea Openeye Name: 1-[4-nitro-2-(trifluoromethyl)phenyl]-3-(tetrahydrofuran-2-ylmethyl)thiourea CAS Name: 1-[4-nitro-2-(trifluoromethyl)phenyl]-3-(2-oxolanylmethyl)thiourea IUPAC Name: 1-[4-nitro-2-(trifluoromethyl)phenyl]-3-(oxolan-2-ylmethyl)thiourea Traditional Name: 1-[4-nitro-2-(trifluoromethyl)phenyl]-3-(tetrahydrofurfuryl)thiourea Formula: C13H14F3N3O3S MolecularWeight: 349.32877

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC(=S)NC2=C(C=C(C=C2)[N+](=O)[O-])C(F)(F)F

Isomeric SMILES

C1CC(OC1)CNC(=S)NC2=C(C=C(C=C2)[N+](=O)[O-])C(F)(F)F

InChI

InChI=1S/C13H14F3N3O3S/c14-13(15,16)10-6-8(19(20)21)3-4-11(10)18-12(23)17-7-9-2-1-5-22-9/h3-4,6,9H,1-2,5,7H2,(H2,17,18,23)