N-[2-tert-butyl-4,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]thiohydroxylamine

Systemtic Name: N-[2-tert-butyl-4,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]thiohydroxylamine Openeye Name: N-[2-tert-butyl-4,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]thiohydroxylamine CAS Name: N-[2-tert-butyl-4,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]thiohydroxylamine IUPAC Name: N-[2-tert-butyl-4,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]thiohydroxylamine Traditional Name: N-[2-tert-butyl-4,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]thiohydroxylamine Formula: C22H23NS MolecularWeight: 343.551338

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1NS)C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

[2H]C1=C(C(=C(C(=C1[2H])[2H])C2=CC(=C(C(=C2)C(C)(C)C)NS)C3=C(C(=C(C(=C3[2H])[2H])[2H])[2H])[2H])[2H])[2H]

InChI

InChI=1S/C22H23NS/c1-22(2,3)20-15-18(16-10-6-4-7-11-16)14-19(21(20)23-24)17-12-8-5-9-13-17/h4-15,23-24H,1-3H3/i4D,5D,6D,7D,8D,9D,10D,11D,12D,13D