[2,5-bis(oxidanylidene)pyrrol-1-yl]methyl thiocyanate

Systemtic Name: [2,5-bis(oxidanylidene)pyrrol-1-yl]methyl thiocyanate Openeye Name: (2,5-dioxopyrrol-1-yl)methyl thiocyanate CAS Name: thiocyanic acid (2,5-dioxo-1-pyrrolyl)methyl ester IUPAC Name: (2,5-dioxopyrrol-1-yl)methyl thiocyanate Traditional Name: thiocyanic acid maleimidomethyl ester Formula: C6H4N2O2S MolecularWeight: 168.17316

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=O)N(C1=O)CSC#N

Isomeric SMILES

C1=CC(=O)N(C1=O)CSC#N

InChI

InChI=1S/C6H4N2O2S/c7-3-11-4-8-5(9)1-2-6(8)10/h1-2H,4H2