2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-N-[(Z)-1-(3-nitrophenyl)ethylideneamino]ethanamide

Systemtic Name: 2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-N-[(Z)-1-(3-nitrophenyl)ethylideneamino]ethanamide Openeye Name: N-[(Z)-1-(3-nitrophenyl)ethylideneamino]-2-[4-(p-tolylsulfonyl)piperazin-1-yl]acetamide CAS Name: 2-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]-N-[(Z)-1-(3-nitrophenyl)ethylideneamino]acetamide IUPAC Name: 2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-N-[(Z)-1-(3-nitrophenyl)ethylideneamino]acetamide Traditional Name: N-[(Z)-1-(3-nitrophenyl)ethylideneamino]-2-(4-tosylpiperazino)acetamide Formula: C21H25N5O5S MolecularWeight: 459.5187

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)NN=C(C)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)N/N=C(/C)\C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H25N5O5S/c1-16-6-8-20(9-7-16)32(30,31)25-12-10-24(11-13-25)15-21(27)23-22-17(2)18-4-3-5-19(14-18)26(28)29/h3-9,14H,10-13,15H2,1-2H3,(H,23,27)/b22-17-