1-[4-[5-(5-nitrothiophen-2-yl)-1,3,4-thiadiazol-2-yl]piperazin-1-yl]ethanone

Systemtic Name: 1-[4-[5-(5-nitrothiophen-2-yl)-1,3,4-thiadiazol-2-yl]piperazin-1-yl]ethanone Openeye Name: 1-[4-[5-(5-nitro-2-thienyl)-1,3,4-thiadiazol-2-yl]piperazin-1-yl]ethanone CAS Name: 1-[4-[5-(5-nitro-2-thiophenyl)-1,3,4-thiadiazol-2-yl]-1-piperazinyl]ethanone IUPAC Name: 1-[4-[5-(5-nitrothiophen-2-yl)-1,3,4-thiadiazol-2-yl]piperazin-1-yl]ethanone Traditional Name: 1-[4-[5-(5-nitro-2-thienyl)-1,3,4-thiadiazol-2-yl]piperazino]ethanone Formula: C12H13N5O3S2 MolecularWeight: 339.39332

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C2=NN=C(S2)C3=CC=C(S3)[N+](=O)[O-]

Isomeric SMILES

CC(=O)N1CCN(CC1)C2=NN=C(S2)C3=CC=C(S3)[N+](=O)[O-]

InChI

InChI=1S/C12H13N5O3S2/c1-8(18)15-4-6-16(7-5-15)12-14-13-11(22-12)9-2-3-10(21-9)17(19)20/h2-3H,4-7H2,1H3