[[4-[cyano(thiophen-2-yl)methylidene]cyclohexa-2,5-dien-1-ylidene]amino] methanesulfonate

Systemtic Name: [[4-[cyano(thiophen-2-yl)methylidene]cyclohexa-2,5-dien-1-ylidene]amino] methanesulfonate Openeye Name: [[4-[cyano(2-thienyl)methylene]cyclohexa-2,5-dien-1-ylidene]amino] methanesulfonate CAS Name: methanesulfonic acid [[4-[cyano(thiophen-2-yl)methylidene]-1-cyclohexa-2,5-dienylidene]amino] ester IUPAC Name: [[4-[cyano(thiophen-2-yl)methylidene]cyclohexa-2,5-dien-1-ylidene]amino] methanesulfonate Traditional Name: methanesulfonic acid [[4-[cyano(2-thienyl)methylene]cyclohexa-2,5-dien-1-ylidene]amino] ester Formula: C13H10N2O3S2 MolecularWeight: 306.3601

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)ON=C1C=CC(=C(C#N)C2=CC=CS2)C=C1

Isomeric SMILES

CS(=O)(=O)ON=C1C=CC(=C(C#N)C2=CC=CS2)C=C1

InChI

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