N-[5-(methoxymethyl)-1,3,4-thiadiazol-2-yl]-4-methyl-3-nitro-benzamide

Systemtic Name: N-[5-(methoxymethyl)-1,3,4-thiadiazol-2-yl]-4-methyl-3-nitro-benzamide Openeye Name: N-[5-(methoxymethyl)-1,3,4-thiadiazol-2-yl]-4-methyl-3-nitro-benzamide CAS Name: N-[5-(methoxymethyl)-1,3,4-thiadiazol-2-yl]-4-methyl-3-nitrobenzamide IUPAC Name: N-[5-(methoxymethyl)-1,3,4-thiadiazol-2-yl]-4-methyl-3-nitrobenzamide Traditional Name: N-[5-(methoxymethyl)-1,3,4-thiadiazol-2-yl]-4-methyl-3-nitro-benzamide Formula: C12H12N4O4S MolecularWeight: 308.31308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=NN=C(S2)COC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=NN=C(S2)COC)[N+](=O)[O-]

InChI

InChI=1S/C12H12N4O4S/c1-7-3-4-8(5-9(7)16(18)19)11(17)13-12-15-14-10(21-12)6-20-2/h3-5H,6H2,1-2H3,(H,13,15,17)