4-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]carbonyl-N-prop-2-ynyl-benzenesulfonamide

Systemtic Name: 4-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]carbonyl-N-prop-2-ynyl-benzenesulfonamide Openeye Name: 4-[4-(2-nitrophenyl)sulfonylpiperazine-1-carbonyl]-N-prop-2-ynyl-benzenesulfonamide CAS Name: 4-[[4-(2-nitrophenyl)sulfonyl-1-piperazinyl]-oxomethyl]-N-prop-2-ynylbenzenesulfonamide IUPAC Name: 4-[4-(2-nitrophenyl)sulfonylpiperazine-1-carbonyl]-N-prop-2-ynylbenzenesulfonamide Traditional Name: 4-[4-(2-nitrophenyl)sulfonylpiperazine-1-carbonyl]-N-propargyl-benzenesulfonamide Formula: C20H20N4O7S2 MolecularWeight: 492.5254

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Descriptors Computed from Structure

Canonical SMILES:

C#CCNS(=O)(=O)C1=CC=C(C=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C#CCNS(=O)(=O)C1=CC=C(C=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C20H20N4O7S2/c1-2-11-21-32(28,29)17-9-7-16(8-10-17)20(25)22-12-14-23(15-13-22)33(30,31)19-6-4-3-5-18(19)24(26)27/h1,3-10,21H,11-15H2