N-[2-(dimethylamino)-2-thiophen-3-yl-ethyl]-4-[(3-nitrophenyl)sulfonylamino]benzamide

Systemtic Name: N-[2-(dimethylamino)-2-thiophen-3-yl-ethyl]-4-[(3-nitrophenyl)sulfonylamino]benzamide Openeye Name: N-[2-(dimethylamino)-2-(3-thienyl)ethyl]-4-[(3-nitrophenyl)sulfonylamino]benzamide CAS Name: N-[2-(dimethylamino)-2-(3-thiophenyl)ethyl]-4-[(3-nitrophenyl)sulfonylamino]benzamide IUPAC Name: N-[2-(dimethylamino)-2-thiophen-3-ylethyl]-4-[(3-nitrophenyl)sulfonylamino]benzamide Traditional Name: N-[2-(dimethylamino)-2-(3-thienyl)ethyl]-4-[(3-nitrophenyl)sulfonylamino]benzamide Formula: C21H22N4O5S2 MolecularWeight: 474.55318

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(CNC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-])C3=CSC=C3

Isomeric SMILES

CN(C)C(CNC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-])C3=CSC=C3

InChI

InChI=1S/C21H22N4O5S2/c1-24(2)20(16-10-11-31-14-16)13-22-21(26)15-6-8-17(9-7-15)23-32(29,30)19-5-3-4-18(12-19)25(27)28/h3-12,14,20,23H,13H2,1-2H3,(H,22,26)