5-nitro-N-[5-(1-propan-2-ylpyrazol-3-yl)-1,3,4-oxadiazol-2-yl]-1-benzothiophene-2-carboxamide

Systemtic Name: 5-nitro-N-[5-(1-propan-2-ylpyrazol-3-yl)-1,3,4-oxadiazol-2-yl]-1-benzothiophene-2-carboxamide Openeye Name: N-[5-(1-isopropylpyrazol-3-yl)-1,3,4-oxadiazol-2-yl]-5-nitro-benzothiophene-2-carboxamide CAS Name: 5-nitro-N-[5-(1-propan-2-yl-3-pyrazolyl)-1,3,4-oxadiazol-2-yl]-1-benzothiophene-2-carboxamide IUPAC Name: 5-nitro-N-[5-(1-propan-2-ylpyrazol-3-yl)-1,3,4-oxadiazol-2-yl]-1-benzothiophene-2-carboxamide Traditional Name: N-[5-(1-isopropylpyrazol-3-yl)-1,3,4-oxadiazol-2-yl]-5-nitro-benzothiophene-2-carboxamide Formula: C17H14N6O4S MolecularWeight: 398.39586

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=CC(=N1)C2=NN=C(O2)NC(=O)C3=CC4=C(S3)C=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

CC(C)N1C=CC(=N1)C2=NN=C(O2)NC(=O)C3=CC4=C(S3)C=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C17H14N6O4S/c1-9(2)22-6-5-12(21-22)16-19-20-17(27-16)18-15(24)14-8-10-7-11(23(25)26)3-4-13(10)28-14/h3-9H,1-2H3,(H,18,20,24)