(2,5-dimethyl-4-thiocyanato-1H-pyrrol-3-yl) thiocyanate

Systemtic Name: (2,5-dimethyl-4-thiocyanato-1H-pyrrol-3-yl) thiocyanate Openeye Name: (2,5-dimethyl-4-thiocyanato-1H-pyrrol-3-yl) thiocyanate CAS Name: thiocyanic acid (2,5-dimethyl-4-thiocyanato-1H-pyrrol-3-yl) ester IUPAC Name: (2,5-dimethyl-4-thiocyanato-1H-pyrrol-3-yl) thiocyanate Traditional Name: thiocyanic acid (2,5-dimethyl-4-thiocyanato-1H-pyrrol-3-yl) ester Formula: C8H7N3S2 MolecularWeight: 209.29128

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1)C)SC#N)SC#N

Isomeric SMILES

CC1=C(C(=C(N1)C)SC#N)SC#N

InChI

InChI=1S/C8H7N3S2/c1-5-7(12-3-9)8(13-4-10)6(2)11-5/h11H,1-2H3