N-(5-methyl-1,2-oxazol-3-yl)-5-nitro-1-benzothiophene-2-carboxamide

Systemtic Name: N-(5-methyl-1,2-oxazol-3-yl)-5-nitro-1-benzothiophene-2-carboxamide Openeye Name: N-(5-methylisoxazol-3-yl)-5-nitro-benzothiophene-2-carboxamide CAS Name: N-(5-methyl-3-isoxazolyl)-5-nitro-1-benzothiophene-2-carboxamide IUPAC Name: N-(5-methyl-1,2-oxazol-3-yl)-5-nitro-1-benzothiophene-2-carboxamide Traditional Name: N-(5-methylisoxazol-3-yl)-5-nitro-benzothiophene-2-carboxamide Formula: C13H9N3O4S MolecularWeight: 303.29326

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=NO1)NC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C13H9N3O4S/c1-7-4-12(15-20-7)14-13(17)11-6-8-5-9(16(18)19)2-3-10(8)21-11/h2-6H,1H3,(H,14,15,17)