(2S)-1-(4-isothiocyanatophenyl)sulfonyl-2-methyl-piperidine

Systemtic Name: (2S)-1-(4-isothiocyanatophenyl)sulfonyl-2-methyl-piperidine Openeye Name: (2S)-1-(4-isothiocyanatophenyl)sulfonyl-2-methyl-piperidine CAS Name: (2S)-1-(4-isothiocyanatophenyl)sulfonyl-2-methylpiperidine IUPAC Name: (2S)-1-(4-isothiocyanatophenyl)sulfonyl-2-methylpiperidine Traditional Name: (2S)-1-(4-isothiocyanatophenyl)sulfonyl-2-methyl-piperidine Formula: C13H16N2O2S2 MolecularWeight: 296.40834

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1S(=O)(=O)C2=CC=C(C=C2)N=C=S

Isomeric SMILES

C[C@H]1CCCCN1S(=O)(=O)C2=CC=C(C=C2)N=C=S

InChI

InChI=1S/C13H16N2O2S2/c1-11-4-2-3-9-15(11)19(16,17)13-7-5-12(6-8-13)14-10-18/h5-8,11H,2-4,9H2,1H3/t11-/m0/s1