N-[5-[(E)-1-(5-nitrofuran-2-yl)but-1-en-2-yl]-1,3,4-thiadiazol-2-yl]ethanamide

Systemtic Name: N-[5-[(E)-1-(5-nitrofuran-2-yl)but-1-en-2-yl]-1,3,4-thiadiazol-2-yl]ethanamide Openeye Name: N-[5-[(1E)-1-[(5-nitro-2-furyl)methylene]propyl]-1,3,4-thiadiazol-2-yl]acetamide CAS Name: N-[5-[(E)-1-(5-nitro-2-furanyl)but-1-en-2-yl]-1,3,4-thiadiazol-2-yl]acetamide IUPAC Name: N-[5-[(E)-1-(5-nitrofuran-2-yl)but-1-en-2-yl]-1,3,4-thiadiazol-2-yl]acetamide Traditional Name: N-[5-[(E)-1-ethyl-2-(5-nitro-2-furyl)vinyl]-1,3,4-thiadiazol-2-yl]acetamide Formula: C12H12N4O4S MolecularWeight: 308.31308

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=CC1=CC=C(O1)[N+](=O)[O-])C2=NN=C(S2)NC(=O)C

Isomeric SMILES

CC/C(=C\C1=CC=C(O1)[N+](=O)[O-])/C2=NN=C(S2)NC(=O)C

InChI

InChI=1S/C12H12N4O4S/c1-3-8(6-9-4-5-10(20-9)16(18)19)11-14-15-12(21-11)13-7(2)17/h4-6H,3H2,1-2H3,(H,13,15,17)/b8-6+