2-[(3,5-dimethylphenyl)-methylsulfonyl-amino]-N-(2-methyl-5-nitro-phenyl)propanamide

Systemtic Name: 2-[(3,5-dimethylphenyl)-methylsulfonyl-amino]-N-(2-methyl-5-nitro-phenyl)propanamide Openeye Name: 2-(3,5-dimethyl-N-methylsulfonyl-anilino)-N-(2-methyl-5-nitro-phenyl)propanamide CAS Name: 2-(3,5-dimethyl-N-methylsulfonylanilino)-N-(2-methyl-5-nitrophenyl)propanamide IUPAC Name: 2-(3,5-dimethyl-N-methylsulfonylanilino)-N-(2-methyl-5-nitrophenyl)propanamide Traditional Name: 2-(N-mesyl-3,5-dimethyl-anilino)-N-(2-methyl-5-nitro-phenyl)propionamide Formula: C19H23N3O5S MolecularWeight: 405.46802

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)C(C)N(C2=CC(=CC(=C2)C)C)S(=O)(=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)C(C)N(C2=CC(=CC(=C2)C)C)S(=O)(=O)C

InChI

InChI=1S/C19H23N3O5S/c1-12-8-13(2)10-17(9-12)21(28(5,26)27)15(4)19(23)20-18-11-16(22(24)25)7-6-14(18)3/h6-11,15H,1-5H3,(H,20,23)