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

Systemtic Name: N-[5-(2-methoxyethylsulfanyl)-1,3,4-thiadiazol-2-yl]-4-nitro-benzamide Openeye Name: N-[5-(2-methoxyethylsulfanyl)-1,3,4-thiadiazol-2-yl]-4-nitro-benzamide CAS Name: N-[5-(2-methoxyethylthio)-1,3,4-thiadiazol-2-yl]-4-nitrobenzamide IUPAC Name: N-[5-(2-methoxyethylsulfanyl)-1,3,4-thiadiazol-2-yl]-4-nitrobenzamide Traditional Name: N-[5-(2-methoxyethylthio)-1,3,4-thiadiazol-2-yl]-4-nitro-benzamide Formula: C12H12N4O4S2 MolecularWeight: 340.37808

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Descriptors Computed from Structure

Canonical SMILES:

COCCSC1=NN=C(S1)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

COCCSC1=NN=C(S1)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C12H12N4O4S2/c1-20-6-7-21-12-15-14-11(22-12)13-10(17)8-2-4-9(5-3-8)16(18)19/h2-5H,6-7H2,1H3,(H,13,14,17)