N-(2,4-dimorpholin-4-ylphenyl)-5-nitro-1-benzothiophene-2-carboxamide

Systemtic Name: N-(2,4-dimorpholin-4-ylphenyl)-5-nitro-1-benzothiophene-2-carboxamide Openeye Name: N-(2,4-dimorpholinophenyl)-5-nitro-benzothiophene-2-carboxamide CAS Name: N-[2,4-bis(4-morpholinyl)phenyl]-5-nitro-1-benzothiophene-2-carboxamide IUPAC Name: N-(2,4-dimorpholin-4-ylphenyl)-5-nitro-1-benzothiophene-2-carboxamide Traditional Name: N-(2,4-dimorpholinophenyl)-5-nitro-benzothiophene-2-carboxamide Formula: C23H24N4O5S MolecularWeight: 468.52546

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC(=C(C=C2)NC(=O)C3=CC4=C(S3)C=CC(=C4)[N+](=O)[O-])N5CCOCC5

Isomeric SMILES

C1COCCN1C2=CC(=C(C=C2)NC(=O)C3=CC4=C(S3)C=CC(=C4)[N+](=O)[O-])N5CCOCC5

InChI

InChI=1S/C23H24N4O5S/c28-23(22-14-16-13-18(27(29)30)2-4-21(16)33-22)24-19-3-1-17(25-5-9-31-10-6-25)15-20(19)26-7-11-32-12-8-26/h1-4,13-15H,5-12H2,(H,24,28)