[(E)-[cyano(thiophen-2-yl)methylidene]amino] 3-chloranylpropane-1-sulfonate

Systemtic Name: [(E)-[cyano(thiophen-2-yl)methylidene]amino] 3-chloranylpropane-1-sulfonate Openeye Name: [(E)-[cyano(2-thienyl)methylene]amino] 3-chloropropane-1-sulfonate CAS Name: 3-chloro-1-propanesulfonic acid IUPAC Name: [(E)-[cyano(thiophen-2-yl)methylidene]amino] 3-chloropropane-1-sulfonate Traditional Name: 3-chloropropane-1-sulfonic acid [(E)-[cyano(2-thienyl)methylene]amino] ester Formula: C9H9ClN2O3S2 MolecularWeight: 292.76236

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C(=NOS(=O)(=O)CCCCl)C#N

Isomeric SMILES

C1=CSC(=C1)/C(=N/OS(=O)(=O)CCCCl)/C#N

InChI

InChI=1S/C9H9ClN2O3S2/c10-4-2-6-17(13,14)15-12-8(7-11)9-3-1-5-16-9/h1,3,5H,2,4,6H2/b12-8+