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

Systemtic Name: [[4-[cyano-(4-methylthiophen-2-yl)methylidene]cyclohexa-2,5-dien-1-ylidene]amino] methanesulfonate Openeye Name: [[4-[cyano-(4-methyl-2-thienyl)methylene]cyclohexa-2,5-dien-1-ylidene]amino] methanesulfonate CAS Name: methanesulfonic acid [[4-[cyano-(4-methyl-2-thiophenyl)methylidene]-1-cyclohexa-2,5-dienylidene]amino] ester IUPAC Name: [[4-[cyano-(4-methylthiophen-2-yl)methylidene]cyclohexa-2,5-dien-1-ylidene]amino] methanesulfonate Traditional Name: methanesulfonic acid [[4-[cyano-(4-methyl-2-thienyl)methylene]cyclohexa-2,5-dien-1-ylidene]amino] ester Formula: C14H12N2O3S2 MolecularWeight: 320.38668

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=C1)C(=C2C=CC(=NOS(=O)(=O)C)C=C2)C#N

Isomeric SMILES

CC1=CSC(=C1)C(=C2C=CC(=NOS(=O)(=O)C)C=C2)C#N

InChI

InChI=1S/C14H12N2O3S2/c1-10-7-14(20-9-10)13(8-15)11-3-5-12(6-4-11)16-19-21(2,17)18/h3-7,9H,1-2H3