(4S)-4-isothiocyanato-2,2-dimethyl-oxane

Systemtic Name: (4S)-4-isothiocyanato-2,2-dimethyl-oxane Openeye Name: (4S)-4-isothiocyanato-2,2-dimethyl-tetrahydropyran CAS Name: (4S)-4-isothiocyanato-2,2-dimethyloxane IUPAC Name: (4S)-4-isothiocyanato-2,2-dimethyloxane Traditional Name: (4S)-4-isothiocyanato-2,2-dimethyl-tetrahydropyran Formula: C8H13NOS MolecularWeight: 171.25992

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CCO1)N=C=S)C

Isomeric SMILES

CC1(C[C@H](CCO1)N=C=S)C

InChI

InChI=1S/C8H13NOS/c1-8(2)5-7(9-6-11)3-4-10-8/h7H,3-5H2,1-2H3/t7-/m0/s1