4-isothiocyanato-1-(1-phenyl-3,4-ditritio-cyclohexyl)piperidine

Systemtic Name: 4-isothiocyanato-1-(1-phenyl-3,4-ditritio-cyclohexyl)piperidine Openeye Name: 4-isothiocyanato-1-(1-phenyl-3,4-ditritio-cyclohexyl)piperidine CAS Name: 4-isothiocyanato-1-(1-phenyl-3,4-ditritiocyclohexyl)piperidine IUPAC Name: 4-isothiocyanato-1-(1-phenyl-3,4-ditritiocyclohexyl)piperidine Traditional Name: 4-isothiocyanato-1-(1-phenyl-3,4-ditritio-cyclohexyl)piperidine Formula: C18H24N2S MolecularWeight: 304.477779

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(C2=CC=CC=C2)N3CCC(CC3)N=C=S

Isomeric SMILES

[3H]C1CCC(CC1[3H])(C2=CC=CC=C2)N3CCC(CC3)N=C=S

InChI

InChI=1S/C18H24N2S/c21-15-19-17-9-13-20(14-10-17)18(11-5-2-6-12-18)16-7-3-1-4-8-16/h1,3-4,7-8,17H,2,5-6,9-14H2/i2T,5T