3-chloranyl-5-nitro-2-prop-2-ynylsulfanyl-pyridine

Systemtic Name: 3-chloranyl-5-nitro-2-prop-2-ynylsulfanyl-pyridine Openeye Name: 3-chloro-5-nitro-2-prop-2-ynylsulfanyl-pyridine CAS Name: 3-chloro-5-nitro-2-(prop-2-ynylthio)pyridine IUPAC Name: 3-chloro-5-nitro-2-prop-2-ynylsulfanylpyridine Traditional Name: 3-chloro-5-nitro-2-(propargylthio)pyridine Formula: C8H5ClN2O2S MolecularWeight: 228.6555

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Descriptors Computed from Structure

Canonical SMILES:

C#CCSC1=C(C=C(C=N1)[N+](=O)[O-])Cl

Isomeric SMILES

C#CCSC1=C(C=C(C=N1)[N+](=O)[O-])Cl

InChI

InChI=1S/C8H5ClN2O2S/c1-2-3-14-8-7(9)4-6(5-10-8)11(12)13/h1,4-5H,3H2