1-(4-bromanyl-3-chloranyl-phenyl)-3-(2-methoxy-4-nitro-phenyl)thiourea

Systemtic Name: 1-(4-bromanyl-3-chloranyl-phenyl)-3-(2-methoxy-4-nitro-phenyl)thiourea Openeye Name: 1-(4-bromo-3-chloro-phenyl)-3-(2-methoxy-4-nitro-phenyl)thiourea CAS Name: 1-(4-bromo-3-chlorophenyl)-3-(2-methoxy-4-nitrophenyl)thiourea IUPAC Name: 1-(4-bromo-3-chlorophenyl)-3-(2-methoxy-4-nitrophenyl)thiourea Traditional Name: 1-(4-bromo-3-chloro-phenyl)-3-(2-methoxy-4-nitro-phenyl)thiourea Formula: C14H11BrClN3O3S MolecularWeight: 416.67744

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=S)NC2=CC(=C(C=C2)Br)Cl

Isomeric SMILES

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=S)NC2=CC(=C(C=C2)Br)Cl

InChI

InChI=1S/C14H11BrClN3O3S/c1-22-13-7-9(19(20)21)3-5-12(13)18-14(23)17-8-2-4-10(15)11(16)6-8/h2-7H,1H3,(H2,17,18,23)