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

Systemtic Name: 2-[[5-[4-(3-nitrophenyl)carbonylpiperazin-1-yl]-1,3,4-thiadiazol-2-yl]sulfanyl]-N-phenyl-ethanamide Openeye Name: 2-[[5-[4-(3-nitrobenzoyl)piperazin-1-yl]-1,3,4-thiadiazol-2-yl]sulfanyl]-N-phenyl-acetamide CAS Name: 2-[[5-[4-[(3-nitrophenyl)-oxomethyl]-1-piperazinyl]-1,3,4-thiadiazol-2-yl]thio]-N-phenylacetamide IUPAC Name: 2-[[5-[4-(3-nitrobenzoyl)piperazin-1-yl]-1,3,4-thiadiazol-2-yl]sulfanyl]-N-phenylacetamide Traditional Name: 2-[[5-[4-(3-nitrobenzoyl)piperazino]-1,3,4-thiadiazol-2-yl]thio]-N-phenyl-acetamide Formula: C21H20N6O4S2 MolecularWeight: 484.5513

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NN=C(S2)SCC(=O)NC3=CC=CC=C3)C(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=NN=C(S2)SCC(=O)NC3=CC=CC=C3)C(=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H20N6O4S2/c28-18(22-16-6-2-1-3-7-16)14-32-21-24-23-20(33-21)26-11-9-25(10-12-26)19(29)15-5-4-8-17(13-15)27(30)31/h1-8,13H,9-12,14H2,(H,22,28)