1-[5-[(4-chlorophenyl)methylsulfanyl]-4-nitro-thiophen-2-yl]ethanone

Systemtic Name: 1-[5-[(4-chlorophenyl)methylsulfanyl]-4-nitro-thiophen-2-yl]ethanone Openeye Name: 1-[5-[(4-chlorophenyl)methylsulfanyl]-4-nitro-2-thienyl]ethanone CAS Name: 1-[5-[(4-chlorophenyl)methylthio]-4-nitro-2-thiophenyl]ethanone IUPAC Name: 1-[5-[(4-chlorophenyl)methylsulfanyl]-4-nitrothiophen-2-yl]ethanone Traditional Name: 1-[5-[(4-chlorobenzyl)thio]-4-nitro-2-thienyl]ethanone Formula: C13H10ClNO3S2 MolecularWeight: 327.8064

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(S1)SCC2=CC=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CC(=O)C1=CC(=C(S1)SCC2=CC=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C13H10ClNO3S2/c1-8(16)12-6-11(15(17)18)13(20-12)19-7-9-2-4-10(14)5-3-9/h2-6H,7H2,1H3