2-[[5-[4-(2-nitrophenyl)carbonylpiperazin-1-yl]-1,3,4-thiadiazol-2-yl]sulfanyl]ethanamide

Systemtic Name: 2-[[5-[4-(2-nitrophenyl)carbonylpiperazin-1-yl]-1,3,4-thiadiazol-2-yl]sulfanyl]ethanamide Openeye Name: 2-[[5-[4-(2-nitrobenzoyl)piperazin-1-yl]-1,3,4-thiadiazol-2-yl]sulfanyl]acetamide CAS Name: 2-[[5-[4-[(2-nitrophenyl)-oxomethyl]-1-piperazinyl]-1,3,4-thiadiazol-2-yl]thio]acetamide IUPAC Name: 2-[[5-[4-(2-nitrobenzoyl)piperazin-1-yl]-1,3,4-thiadiazol-2-yl]sulfanyl]acetamide Traditional Name: 2-[[5-[4-(2-nitrobenzoyl)piperazino]-1,3,4-thiadiazol-2-yl]thio]acetamide Formula: C15H16N6O4S2 MolecularWeight: 408.45534

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NN=C(S2)SCC(=O)N)C(=O)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=NN=C(S2)SCC(=O)N)C(=O)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C15H16N6O4S2/c16-12(22)9-26-15-18-17-14(27-15)20-7-5-19(6-8-20)13(23)10-3-1-2-4-11(10)21(24)25/h1-4H,5-9H2,(H2,16,22)