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1-[(E)-[(3-nitrophenyl)-pyridin-2-yl-methylidene]amino]thiourea

1-[(E)-[(3-nitrophenyl)-pyridin-2-yl-methylidene]amino]thiourea

Systemtic Name:1-[(E)-[(3-nitrophenyl)-pyridin-2-yl-methylidene]amino]thiourea
Openeye Name:[(E)-[(3-nitrophenyl)-(2-pyridyl)methylene]amino]thiourea
CAS Name:[(E)-[(3-nitrophenyl)-(2-pyridinyl)methylidene]amino]thiourea
IUPAC Name:[(E)-[(3-nitrophenyl)-pyridin-2-ylmethylidene]amino]thiourea
Traditional Name:[(E)-[(3-nitrophenyl)-(2-pyridyl)methylene]amino]thiourea
Formula: C13H11N5O2S
MolecularWeight: 301.32374
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C13H11N5O2S/c14-13(21)17-16-12(11-6-1-2-7-15-11)9-4-3-5-10(8-9)18(19)20/h1-8H,(H3,14,17,21)/b16-12+


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