4-(2-isothiocyanatopropan-2-yl)-1-methyl-cyclohexene

Systemtic Name: 4-(2-isothiocyanatopropan-2-yl)-1-methyl-cyclohexene Openeye Name: 4-(1-isothiocyanato-1-methyl-ethyl)-1-methyl-cyclohexene CAS Name: 4-(2-isothiocyanatopropan-2-yl)-1-methylcyclohexene IUPAC Name: 4-(2-isothiocyanatopropan-2-yl)-1-methylcyclohexene Traditional Name: 4-(1-isothiocyanato-1-methyl-ethyl)-1-methyl-cyclohexene Formula: C11H17NS MolecularWeight: 195.32438

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CCC(CC1)C(C)(C)N=C=S

Isomeric SMILES

CC1=CCC(CC1)C(C)(C)N=C=S

InChI

InChI=1S/C11H17NS/c1-9-4-6-10(7-5-9)11(2,3)12-8-13/h4,10H,5-7H2,1-3H3