1-(4-nitrophenyl)-3-(5-nitropyridin-2-yl)thiourea

Systemtic Name: 1-(4-nitrophenyl)-3-(5-nitropyridin-2-yl)thiourea Openeye Name: 1-(4-nitrophenyl)-3-(5-nitro-2-pyridyl)thiourea CAS Name: 1-(4-nitrophenyl)-3-(5-nitro-2-pyridinyl)thiourea IUPAC Name: 1-(4-nitrophenyl)-3-(5-nitropyridin-2-yl)thiourea Traditional Name: 1-(4-nitrophenyl)-3-(5-nitro-2-pyridyl)thiourea Formula: C12H9N5O4S MolecularWeight: 319.29596

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=S)NC2=NC=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1NC(=S)NC2=NC=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C12H9N5O4S/c18-16(19)9-3-1-8(2-4-9)14-12(22)15-11-6-5-10(7-13-11)17(20)21/h1-7H,(H2,13,14,15,22)