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

Systemtic Name: 2-[(5-methyl-1,3,4-thiadiazol-2-yl)carbamoyl]-3-nitro-benzoate Openeye Name: 2-[(5-methyl-1,3,4-thiadiazol-2-yl)carbamoyl]-3-nitro-benzoate CAS Name: 2-[[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-oxomethyl]-3-nitrobenzoate IUPAC Name: 2-[(5-methyl-1,3,4-thiadiazol-2-yl)carbamoyl]-3-nitrobenzoate Traditional Name: 2-[(5-methyl-1,3,4-thiadiazol-2-yl)carbamoyl]-3-nitro-benzoate Formula: C11H7N4O5S- MolecularWeight: 307.26208

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H8N4O5S/c1-5-13-14-11(21-5)12-9(16)8-6(10(17)18)3-2-4-7(8)15(19)20/h2-4H,1H3,(H,17,18)(H,12,14,16)/p-1