4-methyl-N-[3-methyl-2-(2-nitroethanoyl)-1-benzothiophen-5-yl]benzenesulfonamide

Systemtic Name: 4-methyl-N-[3-methyl-2-(2-nitroethanoyl)-1-benzothiophen-5-yl]benzenesulfonamide Openeye Name: 4-methyl-N-[3-methyl-2-(2-nitroacetyl)benzothiophen-5-yl]benzenesulfonamide CAS Name: 4-methyl-N-[3-methyl-2-(2-nitro-1-oxoethyl)-1-benzothiophen-5-yl]benzenesulfonamide IUPAC Name: 4-methyl-N-[3-methyl-2-(2-nitroacetyl)-1-benzothiophen-5-yl]benzenesulfonamide Traditional Name: 4-methyl-N-[3-methyl-2-(2-nitroacetyl)benzothiophen-5-yl]benzenesulfonamide Formula: C18H16N2O5S2 MolecularWeight: 404.46004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC3=C(C=C2)SC(=C3C)C(=O)C[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC3=C(C=C2)SC(=C3C)C(=O)C[N+](=O)[O-]

InChI

InChI=1S/C18H16N2O5S2/c1-11-3-6-14(7-4-11)27(24,25)19-13-5-8-17-15(9-13)12(2)18(26-17)16(21)10-20(22)23/h3-9,19H,10H2,1-2H3