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

Systemtic Name: 1-[4-nitro-2-(trifluoromethyl)phenyl]-3-prop-2-enyl-thiourea Openeye Name: 1-allyl-3-[4-nitro-2-(trifluoromethyl)phenyl]thiourea CAS Name: 1-[4-nitro-2-(trifluoromethyl)phenyl]-3-prop-2-enylthiourea IUPAC Name: 1-[4-nitro-2-(trifluoromethyl)phenyl]-3-prop-2-enylthiourea Traditional Name: 1-allyl-3-[4-nitro-2-(trifluoromethyl)phenyl]thiourea Formula: C11H10F3N3O2S MolecularWeight: 305.27621

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H10F3N3O2S/c1-2-5-15-10(20)16-9-4-3-7(17(18)19)6-8(9)11(12,13)14/h2-4,6H,1,5H2,(H2,15,16,20)