N-methyl-N-[(4-methylsulfanylphenyl)methyl]-4-[(3-nitrophenyl)sulfonylamino]benzamide

Systemtic Name: N-methyl-N-[(4-methylsulfanylphenyl)methyl]-4-[(3-nitrophenyl)sulfonylamino]benzamide Openeye Name: N-methyl-N-[(4-methylsulfanylphenyl)methyl]-4-[(3-nitrophenyl)sulfonylamino]benzamide CAS Name: N-methyl-N-[[4-(methylthio)phenyl]methyl]-4-[(3-nitrophenyl)sulfonylamino]benzamide IUPAC Name: N-methyl-N-[(4-methylsulfanylphenyl)methyl]-4-[(3-nitrophenyl)sulfonylamino]benzamide Traditional Name: N-methyl-N-[4-(methylthio)benzyl]-4-[(3-nitrophenyl)sulfonylamino]benzamide Formula: C22H21N3O5S2 MolecularWeight: 471.54924

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)SC)C(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

CN(CC1=CC=C(C=C1)SC)C(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H21N3O5S2/c1-24(15-16-6-12-20(31-2)13-7-16)22(26)17-8-10-18(11-9-17)23-32(29,30)21-5-3-4-19(14-21)25(27)28/h3-14,23H,15H2,1-2H3