N-(2,3-dimethylphenyl)-2-[methyl-[2-(4-nitrophenyl)sulfanylethanoyl]amino]ethanamide

Systemtic Name: N-(2,3-dimethylphenyl)-2-[methyl-[2-(4-nitrophenyl)sulfanylethanoyl]amino]ethanamide Openeye Name: N-(2,3-dimethylphenyl)-2-[methyl-[2-(4-nitrophenyl)sulfanylacetyl]amino]acetamide CAS Name: N-(2,3-dimethylphenyl)-2-[methyl-[2-[(4-nitrophenyl)thio]-1-oxoethyl]amino]acetamide IUPAC Name: N-(2,3-dimethylphenyl)-2-[methyl-[2-(4-nitrophenyl)sulfanylacetyl]amino]acetamide Traditional Name: N-(2,3-dimethylphenyl)-2-[methyl-[2-[(4-nitrophenyl)thio]acetyl]amino]acetamide Formula: C19H21N3O4S MolecularWeight: 387.45274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=O)CN(C)C(=O)CSC2=CC=C(C=C2)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=O)CN(C)C(=O)CSC2=CC=C(C=C2)[N+](=O)[O-])C

InChI

InChI=1S/C19H21N3O4S/c1-13-5-4-6-17(14(13)2)20-18(23)11-21(3)19(24)12-27-16-9-7-15(8-10-16)22(25)26/h4-10H,11-12H2,1-3H3,(H,20,23)