methyl 2-[[5-(5-nitrothiophen-2-yl)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanoate

Systemtic Name: methyl 2-[[5-(5-nitrothiophen-2-yl)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanoate Openeye Name: methyl 2-[[5-(5-nitro-2-thienyl)-1,3,4-thiadiazol-2-yl]sulfanyl]acetate CAS Name: 2-[[5-(5-nitro-2-thiophenyl)-1,3,4-thiadiazol-2-yl]thio]acetic acid methyl ester IUPAC Name: methyl 2-[[5-(5-nitrothiophen-2-yl)-1,3,4-thiadiazol-2-yl]sulfanyl]acetate Traditional Name: 2-[[5-(5-nitro-2-thienyl)-1,3,4-thiadiazol-2-yl]thio]acetic acid methyl ester Formula: C9H7N3O4S3 MolecularWeight: 317.36458

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CSC1=NN=C(S1)C2=CC=C(S2)[N+](=O)[O-]

Isomeric SMILES

COC(=O)CSC1=NN=C(S1)C2=CC=C(S2)[N+](=O)[O-]

InChI

InChI=1S/C9H7N3O4S3/c1-16-7(13)4-17-9-11-10-8(19-9)5-2-3-6(18-5)12(14)15/h2-3H,4H2,1H3