1-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-3-(4-fluorophenyl)thiourea

Systemtic Name: 1-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-3-(4-fluorophenyl)thiourea Openeye Name: 1-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-3-(4-fluorophenyl)thiourea CAS Name: 1-[2-(4,5-dimethoxy-2-nitrophenyl)ethyl]-3-(4-fluorophenyl)thiourea IUPAC Name: 1-[2-(4,5-dimethoxy-2-nitrophenyl)ethyl]-3-(4-fluorophenyl)thiourea Traditional Name: 1-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-3-(4-fluorophenyl)thiourea Formula: C17H18FN3O4S MolecularWeight: 379.405923

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)CCNC(=S)NC2=CC=C(C=C2)F)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)CCNC(=S)NC2=CC=C(C=C2)F)[N+](=O)[O-])OC

InChI

InChI=1S/C17H18FN3O4S/c1-24-15-9-11(14(21(22)23)10-16(15)25-2)7-8-19-17(26)20-13-5-3-12(18)4-6-13/h3-6,9-10H,7-8H2,1-2H3,(H2,19,20,26)