2-[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-yl]-N-(4-methylsulfanylphenyl)ethanamide

Systemtic Name: 2-[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-yl]-N-(4-methylsulfanylphenyl)ethanamide Openeye Name: 2-[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-yl]-N-(4-methylsulfanylphenyl)acetamide CAS Name: 2-[4-(4-methoxy-3-nitrophenyl)sulfonyl-1-piperazinyl]-N-[4-(methylthio)phenyl]acetamide IUPAC Name: 2-[4-(4-methoxy-3-nitrophenyl)sulfonylpiperazin-1-yl]-N-(4-methylsulfanylphenyl)acetamide Traditional Name: 2-[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazino]-N-[4-(methylthio)phenyl]acetamide Formula: C20H24N4O6S2 MolecularWeight: 480.55776

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)NC3=CC=C(C=C3)SC)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)NC3=CC=C(C=C3)SC)[N+](=O)[O-]

InChI

InChI=1S/C20H24N4O6S2/c1-30-19-8-7-17(13-18(19)24(26)27)32(28,29)23-11-9-22(10-12-23)14-20(25)21-15-3-5-16(31-2)6-4-15/h3-8,13H,9-12,14H2,1-2H3,(H,21,25)