N-(4-tert-butyl-1,3-thiazol-2-yl)-5-nitro-thiophene-2-carboxamide

Systemtic Name: N-(4-tert-butyl-1,3-thiazol-2-yl)-5-nitro-thiophene-2-carboxamide Openeye Name: N-(4-tert-butylthiazol-2-yl)-5-nitro-thiophene-2-carboxamide CAS Name: N-(4-tert-butyl-2-thiazolyl)-5-nitro-2-thiophenecarboxamide IUPAC Name: N-(4-tert-butyl-1,3-thiazol-2-yl)-5-nitrothiophene-2-carboxamide Traditional Name: N-(4-tert-butylthiazol-2-yl)-5-nitro-thiophene-2-carboxamide Formula: C12H13N3O3S2 MolecularWeight: 311.37992

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CSC(=N1)NC(=O)C2=CC=C(S2)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CSC(=N1)NC(=O)C2=CC=C(S2)[N+](=O)[O-]

InChI

InChI=1S/C12H13N3O3S2/c1-12(2,3)8-6-19-11(13-8)14-10(16)7-4-5-9(20-7)15(17)18/h4-6H,1-3H3,(H,13,14,16)