1-(4-nitrophenyl)-3-[(E)-pyridin-2-ylmethylideneamino]thiourea

Systemtic Name: 1-(4-nitrophenyl)-3-[(E)-pyridin-2-ylmethylideneamino]thiourea Openeye Name: 1-(4-nitrophenyl)-3-[(E)-2-pyridylmethyleneamino]thiourea CAS Name: 1-(4-nitrophenyl)-3-[(E)-2-pyridinylmethylideneamino]thiourea IUPAC Name: 1-(4-nitrophenyl)-3-[(E)-pyridin-2-ylmethylideneamino]thiourea Traditional Name: 1-(4-nitrophenyl)-3-[(E)-2-pyridylmethyleneamino]thiourea Formula: C13H11N5O2S MolecularWeight: 301.32374

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H11N5O2S/c19-18(20)12-6-4-10(5-7-12)16-13(21)17-15-9-11-3-1-2-8-14-11/h1-9H,(H2,16,17,21)/b15-9+