1-(4-fluoranyl-3-nitro-phenyl)-3-phenethyl-thiourea

Systemtic Name: 1-(4-fluoranyl-3-nitro-phenyl)-3-phenethyl-thiourea Openeye Name: 1-(4-fluoro-3-nitro-phenyl)-3-phenethyl-thiourea CAS Name: 1-(4-fluoro-3-nitrophenyl)-3-phenethylthiourea IUPAC Name: 1-(4-fluoro-3-nitrophenyl)-3-phenethylthiourea Traditional Name: 1-(4-fluoro-3-nitro-phenyl)-3-phenethyl-thiourea Formula: C15H14FN3O2S MolecularWeight: 319.353963

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=S)NC2=CC(=C(C=C2)F)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=S)NC2=CC(=C(C=C2)F)[N+](=O)[O-]

InChI

InChI=1S/C15H14FN3O2S/c16-13-7-6-12(10-14(13)19(20)21)18-15(22)17-9-8-11-4-2-1-3-5-11/h1-7,10H,8-9H2,(H2,17,18,22)