1-[(E)-[4,5-bis(4-dimethylaminophenyl)-3-nitro-furan-2-yl]methylideneamino]urea

Systemtic Name: 1-[(E)-[4,5-bis(4-dimethylaminophenyl)-3-nitro-furan-2-yl]methylideneamino]urea Openeye Name: [(E)-[4,5-bis(4-dimethylaminophenyl)-3-nitro-2-furyl]methyleneamino]urea CAS Name: [(E)-[4,5-bis(4-dimethylaminophenyl)-3-nitro-2-furanyl]methylideneamino]urea IUPAC Name: [(E)-[4,5-bis(4-dimethylaminophenyl)-3-nitrofuran-2-yl]methylideneamino]urea Traditional Name: [(E)-[4,5-bis(4-dimethylaminophenyl)-3-nitro-2-furyl]methyleneamino]urea Formula: C22H24N6O4 MolecularWeight: 436.46376

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C2=C(OC(=C2[N+](=O)[O-])C=NNC(=O)N)C3=CC=C(C=C3)N(C)C

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C2=C(OC(=C2[N+](=O)[O-])/C=N/NC(=O)N)C3=CC=C(C=C3)N(C)C

InChI

InChI=1S/C22H24N6O4/c1-26(2)16-9-5-14(6-10-16)19-20(28(30)31)18(13-24-25-22(23)29)32-21(19)15-7-11-17(12-8-15)27(3)4/h5-13H,1-4H3,(H3,23,25,29)/b24-13+