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

Systemtic Name: [(E)-[cyano(thiophen-2-yl)methylidene]amino] propane-2-sulfonate Openeye Name: [(E)-[cyano(2-thienyl)methylene]amino] propane-2-sulfonate CAS Name: 2-propanesulfonic acid IUPAC Name: [(E)-[cyano(thiophen-2-yl)methylidene]amino] propane-2-sulfonate Traditional Name: propane-2-sulfonic acid [(E)-[cyano(2-thienyl)methylene]amino] ester Formula: C9H10N2O3S2 MolecularWeight: 258.3173

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H10N2O3S2/c1-7(2)16(12,13)14-11-8(6-10)9-4-3-5-15-9/h3-5,7H,1-2H3/b11-8+