4-methyl-3-nitro-N-[4-(4-pyrazin-2-ylpiperazin-1-yl)sulfonylphenyl]benzamide

Systemtic Name: 4-methyl-3-nitro-N-[4-(4-pyrazin-2-ylpiperazin-1-yl)sulfonylphenyl]benzamide Openeye Name: 4-methyl-3-nitro-N-[4-(4-pyrazin-2-ylpiperazin-1-yl)sulfonylphenyl]benzamide CAS Name: 4-methyl-3-nitro-N-[4-[[4-(2-pyrazinyl)-1-piperazinyl]sulfonyl]phenyl]benzamide IUPAC Name: 4-methyl-3-nitro-N-[4-(4-pyrazin-2-ylpiperazin-1-yl)sulfonylphenyl]benzamide Traditional Name: 4-methyl-3-nitro-N-[4-(4-pyrazin-2-ylpiperazino)sulfonylphenyl]benzamide Formula: C22H22N6O5S MolecularWeight: 482.51228

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCN(CC3)C4=NC=CN=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCN(CC3)C4=NC=CN=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H22N6O5S/c1-16-2-3-17(14-20(16)28(30)31)22(29)25-18-4-6-19(7-5-18)34(32,33)27-12-10-26(11-13-27)21-15-23-8-9-24-21/h2-9,14-15H,10-13H2,1H3,(H,25,29)