N-(2-methyl-5-nitro-phenyl)-4-[[(3-methylphenyl)-methylsulfonyl-amino]methyl]benzamide

Systemtic Name: N-(2-methyl-5-nitro-phenyl)-4-[[(3-methylphenyl)-methylsulfonyl-amino]methyl]benzamide Openeye Name: 4-[(3-methyl-N-methylsulfonyl-anilino)methyl]-N-(2-methyl-5-nitro-phenyl)benzamide CAS Name: 4-[(3-methyl-N-methylsulfonylanilino)methyl]-N-(2-methyl-5-nitrophenyl)benzamide IUPAC Name: 4-[(3-methyl-N-methylsulfonylanilino)methyl]-N-(2-methyl-5-nitrophenyl)benzamide Traditional Name: 4-[(N-mesyl-3-methyl-anilino)methyl]-N-(2-methyl-5-nitro-phenyl)benzamide Formula: C23H23N3O5S MolecularWeight: 453.51082

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N(CC2=CC=C(C=C2)C(=O)NC3=C(C=CC(=C3)[N+](=O)[O-])C)S(=O)(=O)C

Isomeric SMILES

CC1=CC(=CC=C1)N(CC2=CC=C(C=C2)C(=O)NC3=C(C=CC(=C3)[N+](=O)[O-])C)S(=O)(=O)C

InChI

InChI=1S/C23H23N3O5S/c1-16-5-4-6-20(13-16)25(32(3,30)31)15-18-8-10-19(11-9-18)23(27)24-22-14-21(26(28)29)12-7-17(22)2/h4-14H,15H2,1-3H3,(H,24,27)