4-tert-butyl-2-[(4-nitrophenyl)methyl]-1,3-thiazole bromide

Systemtic Name: 4-tert-butyl-2-[(4-nitrophenyl)methyl]-1,3-thiazole bromide Openeye Name: 4-tert-butyl-2-[(4-nitrophenyl)methyl]thiazole bromide CAS Name: 4-tert-butyl-2-[(4-nitrophenyl)methyl]thiazole bromide IUPAC Name: 4-tert-butyl-2-[(4-nitrophenyl)methyl]-1,3-thiazole bromide Traditional Name: 4-tert-butyl-2-(4-nitrobenzyl)thiazole bromide Formula: C14H16BrN2O2S- MolecularWeight: 356.25804

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CSC(=N1)CC2=CC=C(C=C2)[N+](=O)[O-].[Br-]

Isomeric SMILES

CC(C)(C)C1=CSC(=N1)CC2=CC=C(C=C2)[N+](=O)[O-].[Br-]

InChI

InChI=1S/C14H16N2O2S.BrH/c1-14(2,3)12-9-19-13(15-12)8-10-4-6-11(7-5-10)16(17)18;/h4-7,9H,8H2,1-3H3;1H/p-1