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

Systemtic Name: 3-nitro-N-[4-(4-pyrazin-2-ylpiperazin-1-yl)sulfonylphenyl]benzamide Openeye Name: 3-nitro-N-[4-(4-pyrazin-2-ylpiperazin-1-yl)sulfonylphenyl]benzamide CAS Name: 3-nitro-N-[4-[[4-(2-pyrazinyl)-1-piperazinyl]sulfonyl]phenyl]benzamide IUPAC Name: 3-nitro-N-[4-(4-pyrazin-2-ylpiperazin-1-yl)sulfonylphenyl]benzamide Traditional Name: 3-nitro-N-[4-(4-pyrazin-2-ylpiperazino)sulfonylphenyl]benzamide Formula: C21H20N6O5S MolecularWeight: 468.4857

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CN=C2)S(=O)(=O)C3=CC=C(C=C3)NC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=NC=CN=C2)S(=O)(=O)C3=CC=C(C=C3)NC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H20N6O5S/c28-21(16-2-1-3-18(14-16)27(29)30)24-17-4-6-19(7-5-17)33(31,32)26-12-10-25(11-13-26)20-15-22-8-9-23-20/h1-9,14-15H,10-13H2,(H,24,28)