[(3-oxidanylidene-4H-quinoxalin-2-yl)-phenyl-methyl] thiocyanate

Systemtic Name: [(3-oxidanylidene-4H-quinoxalin-2-yl)-phenyl-methyl] thiocyanate Openeye Name: [(3-oxo-4H-quinoxalin-2-yl)-phenyl-methyl] thiocyanate CAS Name: thiocyanic acid [(3-oxo-4H-quinoxalin-2-yl)-phenylmethyl] ester IUPAC Name: [(3-oxo-4H-quinoxalin-2-yl)-phenylmethyl] thiocyanate Traditional Name: thiocyanic acid [(3-keto-4H-quinoxalin-2-yl)-phenyl-methyl] ester Formula: C16H11N3OS MolecularWeight: 293.34304

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=NC3=CC=CC=C3NC2=O)SC#N

Isomeric SMILES

C1=CC=C(C=C1)C(C2=NC3=CC=CC=C3NC2=O)SC#N

InChI

InChI=1S/C16H11N3OS/c17-10-21-15(11-6-2-1-3-7-11)14-16(20)19-13-9-5-4-8-12(13)18-14/h1-9,15H,(H,19,20)