1-(5-nitro-4-phenylsulfanyl-thiophen-2-yl)ethanone

Systemtic Name: 1-(5-nitro-4-phenylsulfanyl-thiophen-2-yl)ethanone Openeye Name: 1-(5-nitro-4-phenylsulfanyl-2-thienyl)ethanone CAS Name: 1-[5-nitro-4-(phenylthio)-2-thiophenyl]ethanone IUPAC Name: 1-(5-nitro-4-phenylsulfanylthiophen-2-yl)ethanone Traditional Name: 1-[5-nitro-4-(phenylthio)-2-thienyl]ethanone Formula: C12H9NO3S2 MolecularWeight: 279.33476

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(S1)[N+](=O)[O-])SC2=CC=CC=C2

Isomeric SMILES

CC(=O)C1=CC(=C(S1)[N+](=O)[O-])SC2=CC=CC=C2

InChI

InChI=1S/C12H9NO3S2/c1-8(14)10-7-11(12(18-10)13(15)16)17-9-5-3-2-4-6-9/h2-7H,1H3