dipropyltin; 2-methylsulfanylpyridine-3-carboxylic acid; hydrate

Systemtic Name: dipropyltin; 2-methylsulfanylpyridine-3-carboxylic acid; hydrate Openeye Name: dipropyltin; 2-methylsulfanylpyridine-3-carboxylic acid; hydrate CAS Name: dipropyltin; 2-(methylthio)-3-pyridinecarboxylic acid; hydrate IUPAC Name: dipropyltin; 2-methylsulfanylpyridine-3-carboxylic acid; hydrate Traditional Name: dipropyltin; 2-(methylthio)nicotinic acid; hydrate Formula: C26H44N2O5S2Sn2 MolecularWeight: 766.18796

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Descriptors Computed from Structure

Canonical SMILES:

CCC[Sn]CCC.CCC[Sn]CCC.CSC1=C(C=CC=N1)C(=O)O.CSC1=C(C=CC=N1)C(=O)O.O

Isomeric SMILES

CCC[Sn]CCC.CCC[Sn]CCC.CSC1=C(C=CC=N1)C(=O)O.CSC1=C(C=CC=N1)C(=O)O.O

InChI

InChI=1S/2C7H7NO2S.4C3H7.H2O.2Sn/c2*1-11-6-5(7(9)10)3-2-4-8-6;4*1-3-2;;;/h2*2-4H,1H3,(H,9,10);4*1,3H2,2H3;1H2;;