2-[(4-chloranyl-3-nitro-phenyl)sulfonyl-(2,4-dimethylphenyl)amino]-N-(3-methylbutan-2-yl)ethanamide

Systemtic Name: 2-[(4-chloranyl-3-nitro-phenyl)sulfonyl-(2,4-dimethylphenyl)amino]-N-(3-methylbutan-2-yl)ethanamide Openeye Name: 2-(N-(4-chloro-3-nitro-phenyl)sulfonyl-2,4-dimethyl-anilino)-N-(1,2-dimethylpropyl)acetamide CAS Name: 2-(N-(4-chloro-3-nitrophenyl)sulfonyl-2,4-dimethylanilino)-N-(3-methylbutan-2-yl)acetamide IUPAC Name: 2-(N-(4-chloro-3-nitrophenyl)sulfonyl-2,4-dimethylanilino)-N-(3-methylbutan-2-yl)acetamide Traditional Name: 2-(N-(4-chloro-3-nitro-phenyl)sulfonyl-2,4-dimethyl-anilino)-N-(1,2-dimethylpropyl)acetamide Formula: C21H26ClN3O5S MolecularWeight: 467.96624

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26ClN3O5S/c1-13(2)16(5)23-21(26)12-24(19-9-6-14(3)10-15(19)4)31(29,30)17-7-8-18(22)20(11-17)25(27)28/h6-11,13,16H,12H2,1-5H3,(H,23,26)