2-[(2-methyl-5-nitro-phenyl)-methylsulfonyl-amino]-N-[1-(4-methylphenyl)propyl]ethanamide

Systemtic Name: 2-[(2-methyl-5-nitro-phenyl)-methylsulfonyl-amino]-N-[1-(4-methylphenyl)propyl]ethanamide Openeye Name: 2-(2-methyl-N-methylsulfonyl-5-nitro-anilino)-N-[1-(p-tolyl)propyl]acetamide CAS Name: 2-(2-methyl-N-methylsulfonyl-5-nitroanilino)-N-[1-(4-methylphenyl)propyl]acetamide IUPAC Name: 2-(2-methyl-N-methylsulfonyl-5-nitroanilino)-N-[1-(4-methylphenyl)propyl]acetamide Traditional Name: 2-(N-mesyl-2-methyl-5-nitro-anilino)-N-[1-(p-tolyl)propyl]acetamide Formula: C20H25N3O5S MolecularWeight: 419.4946

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H25N3O5S/c1-5-18(16-9-6-14(2)7-10-16)21-20(24)13-22(29(4,27)28)19-12-17(23(25)26)11-8-15(19)3/h6-12,18H,5,13H2,1-4H3,(H,21,24)