N-(2-methyl-5-methylsulfonyl-phenyl)-2-(4-nitrophenyl)sulfanyl-propanamide

Systemtic Name: N-(2-methyl-5-methylsulfonyl-phenyl)-2-(4-nitrophenyl)sulfanyl-propanamide Openeye Name: N-(2-methyl-5-methylsulfonyl-phenyl)-2-(4-nitrophenyl)sulfanyl-propanamide CAS Name: N-(2-methyl-5-methylsulfonylphenyl)-2-[(4-nitrophenyl)thio]propanamide IUPAC Name: N-(2-methyl-5-methylsulfonylphenyl)-2-(4-nitrophenyl)sulfanylpropanamide Traditional Name: N-(5-mesyl-2-methyl-phenyl)-2-[(4-nitrophenyl)thio]propionamide Formula: C17H18N2O5S2 MolecularWeight: 394.46522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)C)NC(=O)C(C)SC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)C)NC(=O)C(C)SC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H18N2O5S2/c1-11-4-9-15(26(3,23)24)10-16(11)18-17(20)12(2)25-14-7-5-13(6-8-14)19(21)22/h4-10,12H,1-3H3,(H,18,20)