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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC(=S)NN=CC2=CC=NC=C2)[N+](=O)[O-]

Isomeric SMILES

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

InChI

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