N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-4-nitro-benzamide

Systemtic Name: N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-4-nitro-benzamide Openeye Name: N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-4-nitro-benzamide CAS Name: N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-4-nitrobenzamide IUPAC Name: N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-4-nitrobenzamide Traditional Name: N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-4-nitro-benzamide Formula: C13H14N4O3S MolecularWeight: 306.34026

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN=C(S1)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=NN=C(S1)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H14N4O3S/c1-13(2,3)11-15-16-12(21-11)14-10(18)8-4-6-9(7-5-8)17(19)20/h4-7H,1-3H3,(H,14,16,18)