1-[4-(4-methylsulfonyl-2-nitro-phenyl)piperazin-1-yl]-2-(2-phenyl-1,3-thiazol-4-yl)ethanone

Systemtic Name: 1-[4-(4-methylsulfonyl-2-nitro-phenyl)piperazin-1-yl]-2-(2-phenyl-1,3-thiazol-4-yl)ethanone Openeye Name: 1-[4-(4-methylsulfonyl-2-nitro-phenyl)piperazin-1-yl]-2-(2-phenylthiazol-4-yl)ethanone CAS Name: 1-[4-(4-methylsulfonyl-2-nitrophenyl)-1-piperazinyl]-2-(2-phenyl-4-thiazolyl)ethanone IUPAC Name: 1-[4-(4-methylsulfonyl-2-nitrophenyl)piperazin-1-yl]-2-(2-phenyl-1,3-thiazol-4-yl)ethanone Traditional Name: 1-[4-(4-mesyl-2-nitro-phenyl)piperazino]-2-(2-phenylthiazol-4-yl)ethanone Formula: C22H22N4O5S2 MolecularWeight: 486.56388

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)CC3=CSC(=N3)C4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)CC3=CSC(=N3)C4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H22N4O5S2/c1-33(30,31)18-7-8-19(20(14-18)26(28)29)24-9-11-25(12-10-24)21(27)13-17-15-32-22(23-17)16-5-3-2-4-6-16/h2-8,14-15H,9-13H2,1H3