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

Systemtic Name: 1-[4-nitro-2-(trifluoromethyl)phenyl]-3-propyl-thiourea Openeye Name: 1-[4-nitro-2-(trifluoromethyl)phenyl]-3-propyl-thiourea CAS Name: 1-[4-nitro-2-(trifluoromethyl)phenyl]-3-propylthiourea IUPAC Name: 1-[4-nitro-2-(trifluoromethyl)phenyl]-3-propylthiourea Traditional Name: 1-[4-nitro-2-(trifluoromethyl)phenyl]-3-propyl-thiourea Formula: C11H12F3N3O2S MolecularWeight: 307.29209

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=S)NC1=C(C=C(C=C1)[N+](=O)[O-])C(F)(F)F

Isomeric SMILES

CCCNC(=S)NC1=C(C=C(C=C1)[N+](=O)[O-])C(F)(F)F

InChI

InChI=1S/C11H12F3N3O2S/c1-2-5-15-10(20)16-9-4-3-7(17(18)19)6-8(9)11(12,13)14/h3-4,6H,2,5H2,1H3,(H2,15,16,20)