sodium (6-azanyl-5-nitro-pyrimidin-4-yl)-[(E)-[4-(diethylamino)phenyl]methylideneamino]azanide

Systemtic Name: sodium (6-azanyl-5-nitro-pyrimidin-4-yl)-[(E)-[4-(diethylamino)phenyl]methylideneamino]azanide Openeye Name: sodium (6-amino-5-nitro-pyrimidin-4-yl)-[(E)-[4-(diethylamino)phenyl]methyleneamino]azanide CAS Name: sodium (6-amino-5-nitro-4-pyrimidinyl)-[(E)-[4-(diethylamino)phenyl]methylideneamino]azanide IUPAC Name: sodium (6-amino-5-nitropyrimidin-4-yl)-[(E)-[4-(diethylamino)phenyl]methylideneamino]azanide Traditional Name: sodium (6-amino-5-nitro-pyrimidin-4-yl)-[(E)-[4-(diethylamino)benzylidene]amino]azanide Formula: C15H18N7NaO2 MolecularWeight: 351.33889

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)C=N[N-]C2=C(C(=NC=N2)N)[N+](=O)[O-].[Na+]

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)/C=N/[N-]C2=C(C(=NC=N2)N)[N+](=O)[O-].[Na+]

InChI

InChI=1S/C15H18N7O2.Na/c1-3-21(4-2)12-7-5-11(6-8-12)9-19-20-15-13(22(23)24)14(16)17-10-18-15;/h5-10H,3-4H2,1-2H3,(H2-,16,17,18,20);/q-1;+1/b19-9+;