(2,4-dimethyl-3-phenyl-4-thiocyanato-pentan-2-yl) thiocyanate

Systemtic Name: (2,4-dimethyl-3-phenyl-4-thiocyanato-pentan-2-yl) thiocyanate Openeye Name: (1,1,3-trimethyl-2-phenyl-3-thiocyanato-butyl) thiocyanate CAS Name: thiocyanic acid (2,4-dimethyl-3-phenyl-4-thiocyanatopentan-2-yl) ester IUPAC Name: (2,4-dimethyl-3-phenyl-4-thiocyanatopentan-2-yl) thiocyanate Traditional Name: thiocyanic acid (1,1,3-trimethyl-2-phenyl-3-thiocyanato-butyl) ester Formula: C15H18N2S2 MolecularWeight: 290.44682

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(C1=CC=CC=C1)C(C)(C)SC#N)SC#N

Isomeric SMILES

CC(C)(C(C1=CC=CC=C1)C(C)(C)SC#N)SC#N

InChI

InChI=1S/C15H18N2S2/c1-14(2,18-10-16)13(15(3,4)19-11-17)12-8-6-5-7-9-12/h5-9,13H,1-4H3