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

Systemtic Name: [(E)-[cyano(thiophen-2-yl)methylidene]amino] butane-1-sulfonate Openeye Name: [(E)-[cyano(2-thienyl)methylene]amino] butane-1-sulfonate CAS Name: 1-butanesulfonic acid IUPAC Name: [(E)-[cyano(thiophen-2-yl)methylidene]amino] butane-1-sulfonate Traditional Name: butane-1-sulfonic acid [(E)-[cyano(2-thienyl)methylene]amino] ester Formula: C10H12N2O3S2 MolecularWeight: 272.34388

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)ON=C(C#N)C1=CC=CS1

Isomeric SMILES

CCCCS(=O)(=O)O/N=C(\C#N)/C1=CC=CS1

InChI

InChI=1S/C10H12N2O3S2/c1-2-3-7-17(13,14)15-12-9(8-11)10-5-4-6-16-10/h4-6H,2-3,7H2,1H3/b12-9+