5-(azepan-1-ylsulfonyl)pyridine-2-thiolate

Systemtic Name: 5-(azepan-1-ylsulfonyl)pyridine-2-thiolate Openeye Name: 5-(azepan-1-ylsulfonyl)pyridine-2-thiolate CAS Name: 5-(1-azepanylsulfonyl)-2-pyridinethiolate IUPAC Name: 5-(azepan-1-ylsulfonyl)pyridine-2-thiolate Traditional Name: 5-(azepan-1-ylsulfonyl)pyridine-2-thiolate Formula: C11H15N2O2S2- MolecularWeight: 271.379

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CN=C(C=C2)[S-]

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CN=C(C=C2)[S-]

InChI

InChI=1S/C11H16N2O2S2/c14-17(15,10-5-6-11(16)12-9-10)13-7-3-1-2-4-8-13/h5-6,9H,1-4,7-8H2,(H,12,16)/p-1