N-[(2S)-2-(dimethylamino)-2-thiophen-2-yl-ethyl]-4,5-dimethoxy-2-nitro-benzamide

Systemtic Name: N-[(2S)-2-(dimethylamino)-2-thiophen-2-yl-ethyl]-4,5-dimethoxy-2-nitro-benzamide Openeye Name: N-[(2S)-2-(dimethylamino)-2-(2-thienyl)ethyl]-4,5-dimethoxy-2-nitro-benzamide CAS Name: N-[(2S)-2-(dimethylamino)-2-thiophen-2-ylethyl]-4,5-dimethoxy-2-nitrobenzamide IUPAC Name: N-[(2S)-2-(dimethylamino)-2-thiophen-2-ylethyl]-4,5-dimethoxy-2-nitrobenzamide Traditional Name: N-[(2S)-2-(dimethylamino)-2-(2-thienyl)ethyl]-4,5-dimethoxy-2-nitro-benzamide Formula: C17H21N3O5S MolecularWeight: 379.43074

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(CNC(=O)C1=CC(=C(C=C1[N+](=O)[O-])OC)OC)C2=CC=CS2

Isomeric SMILES

CN(C)[C@@H](CNC(=O)C1=CC(=C(C=C1[N+](=O)[O-])OC)OC)C2=CC=CS2

InChI

InChI=1S/C17H21N3O5S/c1-19(2)13(16-6-5-7-26-16)10-18-17(21)11-8-14(24-3)15(25-4)9-12(11)20(22)23/h5-9,13H,10H2,1-4H3,(H,18,21)/t13-/m0/s1