[[1-(oxidanylamino)-1-oxidanylidene-heptan-2-yl]amino] 5-pyridin-2-ylthiophene-2-sulfinate

Systemtic Name: [[1-(oxidanylamino)-1-oxidanylidene-heptan-2-yl]amino] 5-pyridin-2-ylthiophene-2-sulfinate Openeye Name: [1-(hydroxycarbamoyl)hexylamino] 5-(2-pyridyl)thiophene-2-sulfinate CAS Name: 5-(2-pyridinyl)-2-thiophenesulfinic acid [[1-(hydroxyamino)-1-oxoheptan-2-yl]amino] ester IUPAC Name: [[1-(hydroxyamino)-1-oxoheptan-2-yl]amino] 5-pyridin-2-ylthiophene-2-sulfinate Traditional Name: 5-(2-pyridyl)thiophene-2-sulfinic acid [1-(hydroxycarbamoyl)hexylamino] ester Formula: C16H21N3O4S2 MolecularWeight: 383.48564

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C(=O)NO)NOS(=O)C1=CC=C(S1)C2=CC=CC=N2

Isomeric SMILES

CCCCCC(C(=O)NO)NOS(=O)C1=CC=C(S1)C2=CC=CC=N2

InChI

InChI=1S/C16H21N3O4S2/c1-2-3-4-8-13(16(20)18-21)19-23-25(22)15-10-9-14(24-15)12-7-5-6-11-17-12/h5-7,9-11,13,19,21H,2-4,8H2,1H3,(H,18,20)