1,3-bis[(4-nitrophenyl)amino]thiourea

Systemtic Name: 1,3-bis[(4-nitrophenyl)amino]thiourea Openeye Name: 1,3-bis(4-nitroanilino)thiourea CAS Name: 1,3-bis(4-nitroanilino)thiourea IUPAC Name: 1,3-bis(4-nitroanilino)thiourea Traditional Name: 1,3-bis(4-nitroanilino)thiourea Formula: C13H12N6O4S MolecularWeight: 348.33718

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NNC(=S)NNC2=CC=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1NNC(=S)NNC2=CC=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C13H12N6O4S/c20-18(21)11-5-1-9(2-6-11)14-16-13(24)17-15-10-3-7-12(8-4-10)19(22)23/h1-8,14-15H,(H2,16,17,24)