N-(5-nitropyridin-2-yl)-3-[3-[(5-nitropyridin-2-yl)amino]-3-oxidanylidene-propyl]sulfanyl-propanamide

Systemtic Name: N-(5-nitropyridin-2-yl)-3-[3-[(5-nitropyridin-2-yl)amino]-3-oxidanylidene-propyl]sulfanyl-propanamide Openeye Name: N-(5-nitro-2-pyridyl)-3-[3-[(5-nitro-2-pyridyl)amino]-3-oxo-propyl]sulfanyl-propanamide CAS Name: N-(5-nitro-2-pyridinyl)-3-[[3-[(5-nitro-2-pyridinyl)amino]-3-oxopropyl]thio]propanamide IUPAC Name: N-(5-nitropyridin-2-yl)-3-[3-[(5-nitropyridin-2-yl)amino]-3-oxopropyl]sulfanylpropanamide Traditional Name: 3-[[3-keto-3-[(5-nitro-2-pyridyl)amino]propyl]thio]-N-(5-nitro-2-pyridyl)propionamide Formula: C16H16N6O6S MolecularWeight: 420.39984

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H16N6O6S/c23-15(19-13-3-1-11(9-17-13)21(25)26)5-7-29-8-6-16(24)20-14-4-2-12(10-18-14)22(27)28/h1-4,9-10H,5-8H2,(H,17,19,23)(H,18,20,24)