1-(5-bromanylpyridin-2-yl)-3-(3-nitrophenyl)thiourea

Systemtic Name: 1-(5-bromanylpyridin-2-yl)-3-(3-nitrophenyl)thiourea Openeye Name: 1-(5-bromo-2-pyridyl)-3-(3-nitrophenyl)thiourea CAS Name: 1-(5-bromo-2-pyridinyl)-3-(3-nitrophenyl)thiourea IUPAC Name: 1-(5-bromopyridin-2-yl)-3-(3-nitrophenyl)thiourea Traditional Name: 1-(5-bromo-2-pyridyl)-3-(3-nitrophenyl)thiourea Formula: C12H9BrN4O2S MolecularWeight: 353.19446

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H9BrN4O2S/c13-8-4-5-11(14-7-8)16-12(20)15-9-2-1-3-10(6-9)17(18)19/h1-7H,(H2,14,15,16,20)