N-[4-(5-ethoxy-1-benzofuran-2-yl)-1,3-thiazol-2-yl]-5-nitro-1-benzothiophene-2-carboxamide

Systemtic Name: N-[4-(5-ethoxy-1-benzofuran-2-yl)-1,3-thiazol-2-yl]-5-nitro-1-benzothiophene-2-carboxamide Openeye Name: N-[4-(5-ethoxybenzofuran-2-yl)thiazol-2-yl]-5-nitro-benzothiophene-2-carboxamide CAS Name: N-[4-(5-ethoxy-2-benzofuranyl)-2-thiazolyl]-5-nitro-1-benzothiophene-2-carboxamide IUPAC Name: N-[4-(5-ethoxy-1-benzofuran-2-yl)-1,3-thiazol-2-yl]-5-nitro-1-benzothiophene-2-carboxamide Traditional Name: N-[4-(5-ethoxybenzofuran-2-yl)thiazol-2-yl]-5-nitro-benzothiophene-2-carboxamide Formula: C22H15N3O5S2 MolecularWeight: 465.5016

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)OC(=C2)C3=CSC(=N3)NC(=O)C4=CC5=C(S4)C=CC(=C5)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC2=C(C=C1)OC(=C2)C3=CSC(=N3)NC(=O)C4=CC5=C(S4)C=CC(=C5)[N+](=O)[O-]

InChI

InChI=1S/C22H15N3O5S2/c1-2-29-15-4-5-17-12(8-15)9-18(30-17)16-11-31-22(23-16)24-21(26)20-10-13-7-14(25(27)28)3-6-19(13)32-20/h3-11H,2H2,1H3,(H,23,24,26)