1-[4-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-3-nitro-phenyl]ethanone

Systemtic Name: 1-[4-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-3-nitro-phenyl]ethanone Openeye Name: 1-[4-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-3-nitro-phenyl]ethanone CAS Name: 1-[4-[(5-methyl-1,3,4-thiadiazol-2-yl)thio]-3-nitrophenyl]ethanone IUPAC Name: 1-[4-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-3-nitrophenyl]ethanone Traditional Name: 1-[4-[(5-methyl-1,3,4-thiadiazol-2-yl)thio]-3-nitro-phenyl]ethanone Formula: C11H9N3O3S2 MolecularWeight: 295.33746

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(S1)SC2=C(C=C(C=C2)C(=O)C)[N+](=O)[O-]

Isomeric SMILES

CC1=NN=C(S1)SC2=C(C=C(C=C2)C(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C11H9N3O3S2/c1-6(15)8-3-4-10(9(5-8)14(16)17)19-11-13-12-7(2)18-11/h3-5H,1-2H3