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

Systemtic Name: 4-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-3-nitro-benzoate Openeye Name: 4-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-3-nitro-benzoate CAS Name: 4-[(5-methyl-1,3,4-thiadiazol-2-yl)thio]-3-nitrobenzoate IUPAC Name: 4-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-3-nitrobenzoate Traditional Name: 4-[(5-methyl-1,3,4-thiadiazol-2-yl)thio]-3-nitro-benzoate Formula: C10H6N3O4S2- MolecularWeight: 296.30234

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H7N3O4S2/c1-5-11-12-10(18-5)19-8-3-2-6(9(14)15)4-7(8)13(16)17/h2-4H,1H3,(H,14,15)/p-1