2-(5-bromanyl-3-nitro-1,2,4-triazol-1-yl)-N-(4-tert-butyl-1,3-thiazol-2-yl)ethanamide

Systemtic Name: 2-(5-bromanyl-3-nitro-1,2,4-triazol-1-yl)-N-(4-tert-butyl-1,3-thiazol-2-yl)ethanamide Openeye Name: 2-(5-bromo-3-nitro-1,2,4-triazol-1-yl)-N-(4-tert-butylthiazol-2-yl)acetamide CAS Name: 2-(5-bromo-3-nitro-1,2,4-triazol-1-yl)-N-(4-tert-butyl-2-thiazolyl)acetamide IUPAC Name: 2-(5-bromo-3-nitro-1,2,4-triazol-1-yl)-N-(4-tert-butyl-1,3-thiazol-2-yl)acetamide Traditional Name: 2-(5-bromo-3-nitro-1,2,4-triazol-1-yl)-N-(4-tert-butylthiazol-2-yl)acetamide Formula: C11H13BrN6O3S MolecularWeight: 389.22832

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CSC(=N1)NC(=O)CN2C(=NC(=N2)[N+](=O)[O-])Br

Isomeric SMILES

CC(C)(C)C1=CSC(=N1)NC(=O)CN2C(=NC(=N2)[N+](=O)[O-])Br

InChI

InChI=1S/C11H13BrN6O3S/c1-11(2,3)6-5-22-10(13-6)14-7(19)4-17-8(12)15-9(16-17)18(20)21/h5H,4H2,1-3H3,(H,13,14,19)