2-[2-[4-(2-nitrophenyl)piperazin-1-yl]carbonylphenyl]sulfanylethanamide

Systemtic Name: 2-[2-[4-(2-nitrophenyl)piperazin-1-yl]carbonylphenyl]sulfanylethanamide Openeye Name: 2-[2-[4-(2-nitrophenyl)piperazine-1-carbonyl]phenyl]sulfanylacetamide CAS Name: 2-[[2-[[4-(2-nitrophenyl)-1-piperazinyl]-oxomethyl]phenyl]thio]acetamide IUPAC Name: 2-[2-[4-(2-nitrophenyl)piperazine-1-carbonyl]phenyl]sulfanylacetamide Traditional Name: 2-[[2-[4-(2-nitrophenyl)piperazine-1-carbonyl]phenyl]thio]acetamide Formula: C19H20N4O4S MolecularWeight: 400.4515

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2[N+](=O)[O-])C(=O)C3=CC=CC=C3SCC(=O)N

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2[N+](=O)[O-])C(=O)C3=CC=CC=C3SCC(=O)N

InChI

InChI=1S/C19H20N4O4S/c20-18(24)13-28-17-8-4-1-5-14(17)19(25)22-11-9-21(10-12-22)15-6-2-3-7-16(15)23(26)27/h1-8H,9-13H2,(H2,20,24)