3-nitro-N-[2-(phenylsulfonyl)-2-thiophen-2-yl-ethyl]benzamide

Systemtic Name: 3-nitro-N-[2-(phenylsulfonyl)-2-thiophen-2-yl-ethyl]benzamide Openeye Name: N-[2-(benzenesulfonyl)-2-(2-thienyl)ethyl]-3-nitro-benzamide CAS Name: N-[2-(benzenesulfonyl)-2-thiophen-2-ylethyl]-3-nitrobenzamide IUPAC Name: N-[2-(benzenesulfonyl)-2-thiophen-2-ylethyl]-3-nitrobenzamide Traditional Name: N-[2-besyl-2-(2-thienyl)ethyl]-3-nitro-benzamide Formula: C19H16N2O5S2 MolecularWeight: 416.47074

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)C(CNC(=O)C2=CC(=CC=C2)[N+](=O)[O-])C3=CC=CS3

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)C(CNC(=O)C2=CC(=CC=C2)[N+](=O)[O-])C3=CC=CS3

InChI

InChI=1S/C19H16N2O5S2/c22-19(14-6-4-7-15(12-14)21(23)24)20-13-18(17-10-5-11-27-17)28(25,26)16-8-2-1-3-9-16/h1-12,18H,13H2,(H,20,22)