5-nitro-2-oxidanylidene-1-[(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)methyl]pyridine-3-carbonitrile

Systemtic Name: 5-nitro-2-oxidanylidene-1-[(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)methyl]pyridine-3-carbonitrile Openeye Name: 5-nitro-2-oxo-1-[[3-(3-thienyl)-1,2,4-oxadiazol-5-yl]methyl]pyridine-3-carbonitrile CAS Name: 5-nitro-2-oxo-1-[[3-(3-thiophenyl)-1,2,4-oxadiazol-5-yl]methyl]-3-pyridinecarbonitrile IUPAC Name: 5-nitro-2-oxo-1-[(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)methyl]pyridine-3-carbonitrile Traditional Name: 2-keto-5-nitro-1-[[3-(3-thienyl)-1,2,4-oxadiazol-5-yl]methyl]nicotinonitrile Formula: C13H7N5O4S MolecularWeight: 329.29078

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC=C1C2=NOC(=N2)CN3C=C(C=C(C3=O)C#N)[N+](=O)[O-]

Isomeric SMILES

C1=CSC=C1C2=NOC(=N2)CN3C=C(C=C(C3=O)C#N)[N+](=O)[O-]

InChI

InChI=1S/C13H7N5O4S/c14-4-9-3-10(18(20)21)5-17(13(9)19)6-11-15-12(16-22-11)8-1-2-23-7-8/h1-3,5,7H,6H2