O-[4,8-bis(ethenyl)-9,10-bis(oxidanylidene)-2-adamantyl] pyrazole-1-carbothioate

Systemtic Name: O-[4,8-bis(ethenyl)-9,10-bis(oxidanylidene)-2-adamantyl] pyrazole-1-carbothioate Openeye Name: O-(4,8-dioxo-9,10-divinyl-2-adamantyl) pyrazole-1-carbothioate CAS Name: 1-pyrazolecarbothioic acid O-[4,8-bis(ethenyl)-9,10-dioxo-2-adamantyl] ester IUPAC Name: O-[4,8-bis(ethenyl)-9,10-dioxo-2-adamantyl] pyrazole-1-carbothioate Traditional Name: pyrazole-1-carbothioic acid O-(4,8-diketo-9,10-divinyl-2-adamantyl) ester Formula: C18H18N2O3S MolecularWeight: 342.41212

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Descriptors Computed from Structure

Canonical SMILES:

C=CC1C2CC3C(C(C2=O)C(C1C3=O)OC(=S)N4C=CC=N4)C=C

Isomeric SMILES

C=CC1C2CC3C(C(C2=O)C(C1C3=O)OC(=S)N4C=CC=N4)C=C

InChI

InChI=1S/C18H18N2O3S/c1-3-9-11-8-12-10(4-2)14(15(11)21)17(13(9)16(12)22)23-18(24)20-7-5-6-19-20/h3-7,9-14,17H,1-2,8H2