1-(4-bromophenyl)-3-[4-nitro-2-(phenylcarbonyl)phenyl]thiourea

Systemtic Name: 1-(4-bromophenyl)-3-[4-nitro-2-(phenylcarbonyl)phenyl]thiourea Openeye Name: 1-(2-benzoyl-4-nitro-phenyl)-3-(4-bromophenyl)thiourea CAS Name: 1-(2-benzoyl-4-nitrophenyl)-3-(4-bromophenyl)thiourea IUPAC Name: 1-(2-benzoyl-4-nitrophenyl)-3-(4-bromophenyl)thiourea Traditional Name: 1-(2-benzoyl-4-nitro-phenyl)-3-(4-bromophenyl)thiourea Formula: C20H14BrN3O3S MolecularWeight: 456.31246

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2=C(C=CC(=C2)[N+](=O)[O-])NC(=S)NC3=CC=C(C=C3)Br

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C2=C(C=CC(=C2)[N+](=O)[O-])NC(=S)NC3=CC=C(C=C3)Br

InChI

InChI=1S/C20H14BrN3O3S/c21-14-6-8-15(9-7-14)22-20(28)23-18-11-10-16(24(26)27)12-17(18)19(25)13-4-2-1-3-5-13/h1-12H,(H2,22,23,28)