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

Systemtic Name: N-(2-methyl-5-nitro-phenyl)-2-[(4-methylphenyl)-methylsulfonyl-amino]propanamide Openeye Name: 2-(4-methyl-N-methylsulfonyl-anilino)-N-(2-methyl-5-nitro-phenyl)propanamide CAS Name: 2-(4-methyl-N-methylsulfonylanilino)-N-(2-methyl-5-nitrophenyl)propanamide IUPAC Name: 2-(4-methyl-N-methylsulfonylanilino)-N-(2-methyl-5-nitrophenyl)propanamide Traditional Name: 2-(N-mesyl-4-methyl-anilino)-N-(2-methyl-5-nitro-phenyl)propionamide Formula: C18H21N3O5S MolecularWeight: 391.44144

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21N3O5S/c1-12-5-8-15(9-6-12)20(27(4,25)26)14(3)18(22)19-17-11-16(21(23)24)10-7-13(17)2/h5-11,14H,1-4H3,(H,19,22)