[(E)-1-[5-[(E)-N-isothiocyanato-C-methyl-carbonimidoyl]-1-methyl-pyrrol-2-yl]ethylideneamino] thiocyanate

Systemtic Name: [(E)-1-[5-[(E)-N-isothiocyanato-C-methyl-carbonimidoyl]-1-methyl-pyrrol-2-yl]ethylideneamino] thiocyanate Openeye Name: [(E)-1-[5-[(E)-N-isothiocyanato-C-methyl-carbonimidoyl]-1-methyl-pyrrol-2-yl]ethylideneamino] thiocyanate CAS Name: thiocyanic acid [(E)-1-[1-methyl-5-[(1E)-1-(sulfanylidenemethylidenehydrazinylidene)ethyl]-2-pyrrolyl]ethylideneamino] ester IUPAC Name: [(E)-1-[5-[(E)-N-isothiocyanato-C-methylcarbonimidoyl]-1-methylpyrrol-2-yl]ethylideneamino] thiocyanate Traditional Name: thiocyanic acid [(E)-1-[5-[(E)-N-isothiocyanato-C-methyl-carbonimidoyl]-1-methyl-pyrrol-2-yl]ethylideneamino] ester Formula: C11H11N5S2 MolecularWeight: 277.36854

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NN=C=S)C1=CC=C(N1C)C(=NSC#N)C

Isomeric SMILES

C/C(=N\N=C=S)/C1=CC=C(N1C)/C(=N/SC#N)/C

InChI

InChI=1S/C11H11N5S2/c1-8(14-13-7-17)10-4-5-11(16(10)3)9(2)15-18-6-12/h4-5H,1-3H3/b14-8+,15-9+