cyanomethyl 3-[5-[(Z)-(5-oxidanylidene-2-sulfanylidene-imidazolidin-4-ylidene)methyl]furan-2-yl]benzoate

Systemtic Name: cyanomethyl 3-[5-[(Z)-(5-oxidanylidene-2-sulfanylidene-imidazolidin-4-ylidene)methyl]furan-2-yl]benzoate Openeye Name: cyanomethyl 3-[5-[(Z)-(5-oxo-2-thioxo-imidazolidin-4-ylidene)methyl]-2-furyl]benzoate CAS Name: 3-[5-[(Z)-(5-oxo-2-sulfanylidene-4-imidazolidinylidene)methyl]-2-furanyl]benzoic acid cyanomethyl ester IUPAC Name: cyanomethyl 3-[5-[(Z)-(5-oxo-2-sulfanylideneimidazolidin-4-ylidene)methyl]furan-2-yl]benzoate Traditional Name: 3-[5-[(Z)-(5-keto-2-thioxo-imidazolidin-4-ylidene)methyl]-2-furyl]benzoic acid cyanomethyl ester Formula: C17H11N3O4S MolecularWeight: 353.35194

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(=O)OCC#N)C2=CC=C(O2)C=C3C(=O)NC(=S)N3

Isomeric SMILES

C1=CC(=CC(=C1)C(=O)OCC#N)C2=CC=C(O2)/C=C\3/C(=O)NC(=S)N3

InChI

InChI=1S/C17H11N3O4S/c18-6-7-23-16(22)11-3-1-2-10(8-11)14-5-4-12(24-14)9-13-15(21)20-17(25)19-13/h1-5,8-9H,7H2,(H2,19,20,21,25)/b13-9-