2,6-diisothiocyanato-2,6-dimethyl-heptane

Systemtic Name: 2,6-diisothiocyanato-2,6-dimethyl-heptane Openeye Name: 2,6-diisothiocyanato-2,6-dimethyl-heptane CAS Name: 2,6-diisothiocyanato-2,6-dimethylheptane IUPAC Name: 2,6-diisothiocyanato-2,6-dimethylheptane Traditional Name: 2,6-diisothiocyanato-2,6-dimethyl-heptane Formula: C11H18N2S2 MolecularWeight: 242.40402

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCCC(C)(C)N=C=S)N=C=S

Isomeric SMILES

CC(C)(CCCC(C)(C)N=C=S)N=C=S

InChI

InChI=1S/C11H18N2S2/c1-10(2,12-8-14)6-5-7-11(3,4)13-9-15/h5-7H2,1-4H3