(2,5-dimethyl-4-thiocyanato-hexa-2,4-dien-3-yl) thiocyanate

Systemtic Name: (2,5-dimethyl-4-thiocyanato-hexa-2,4-dien-3-yl) thiocyanate Openeye Name: (1-isopropylidene-3-methyl-2-thiocyanato-but-2-enyl) thiocyanate CAS Name: thiocyanic acid (2,5-dimethyl-4-thiocyanatohexa-2,4-dien-3-yl) ester IUPAC Name: (2,5-dimethyl-4-thiocyanatohexa-2,4-dien-3-yl) thiocyanate Traditional Name: thiocyanic acid (1-isopropylidene-3-methyl-2-thiocyanato-but-2-enyl) ester Formula: C10H12N2S2 MolecularWeight: 224.34568

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C(=C(C)C)SC#N)SC#N)C

Isomeric SMILES

CC(=C(C(=C(C)C)SC#N)SC#N)C

InChI

InChI=1S/C10H12N2S2/c1-7(2)9(13-5-11)10(8(3)4)14-6-12/h1-4H3