[(Z)-[cyano(thiophen-3-yl)methylidene]amino] 4-methylbenzenesulfonate

Systemtic Name: [(Z)-[cyano(thiophen-3-yl)methylidene]amino] 4-methylbenzenesulfonate Openeye Name: [(Z)-[cyano(3-thienyl)methylene]amino] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(Z)-[cyano(3-thiophenyl)methylidene]amino] ester IUPAC Name: [(Z)-[cyano(thiophen-3-yl)methylidene]amino] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(Z)-[cyano(3-thienyl)methylene]amino] ester Formula: C13H10N2O3S2 MolecularWeight: 306.3601

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)ON=C(C#N)C2=CSC=C2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O/N=C(\C#N)/C2=CSC=C2

InChI

InChI=1S/C13H10N2O3S2/c1-10-2-4-12(5-3-10)20(16,17)18-15-13(8-14)11-6-7-19-9-11/h2-7,9H,1H3/b15-13+