N-[2-(2,6-dimethylmorpholin-4-yl)sulfonylethyl]-5-nitro-1-benzothiophene-2-carboxamide

Systemtic Name: N-[2-(2,6-dimethylmorpholin-4-yl)sulfonylethyl]-5-nitro-1-benzothiophene-2-carboxamide Openeye Name: N-[2-(2,6-dimethylmorpholin-4-yl)sulfonylethyl]-5-nitro-benzothiophene-2-carboxamide CAS Name: N-[2-[(2,6-dimethyl-4-morpholinyl)sulfonyl]ethyl]-5-nitro-1-benzothiophene-2-carboxamide IUPAC Name: N-[2-(2,6-dimethylmorpholin-4-yl)sulfonylethyl]-5-nitro-1-benzothiophene-2-carboxamide Traditional Name: N-[2-(2,6-dimethylmorpholino)sulfonylethyl]-5-nitro-benzothiophene-2-carboxamide Formula: C17H21N3O6S2 MolecularWeight: 427.49514

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(O1)C)S(=O)(=O)CCNC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

CC1CN(CC(O1)C)S(=O)(=O)CCNC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H21N3O6S2/c1-11-9-19(10-12(2)26-11)28(24,25)6-5-18-17(21)16-8-13-7-14(20(22)23)3-4-15(13)27-16/h3-4,7-8,11-12H,5-6,9-10H2,1-2H3,(H,18,21)