N-[2-(6-chloranyl-3-methyl-2,4-dinitro-phenyl)sulfanylethyl]ethanamide

Systemtic Name: N-[2-(6-chloranyl-3-methyl-2,4-dinitro-phenyl)sulfanylethyl]ethanamide Openeye Name: N-[2-(6-chloro-3-methyl-2,4-dinitro-phenyl)sulfanylethyl]acetamide CAS Name: N-[2-[(6-chloro-3-methyl-2,4-dinitrophenyl)thio]ethyl]acetamide IUPAC Name: N-[2-(6-chloro-3-methyl-2,4-dinitrophenyl)sulfanylethyl]acetamide Traditional Name: N-[2-[(6-chloro-3-methyl-2,4-dinitro-phenyl)thio]ethyl]acetamide Formula: C11H12ClN3O5S MolecularWeight: 333.74808

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1[N+](=O)[O-])Cl)SCCNC(=O)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=C(C=C1[N+](=O)[O-])Cl)SCCNC(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C11H12ClN3O5S/c1-6-9(14(17)18)5-8(12)11(10(6)15(19)20)21-4-3-13-7(2)16/h5H,3-4H2,1-2H3,(H,13,16)