(3-azanylpyrazin-2-yl)-[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: (3-azanylpyrazin-2-yl)-[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-yl]methanone Openeye Name: (3-aminopyrazin-2-yl)-[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-yl]methanone CAS Name: (3-amino-2-pyrazinyl)-[4-(4-methoxy-3-nitrophenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: (3-aminopyrazin-2-yl)-[4-(4-methoxy-3-nitrophenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: (3-aminopyrazin-2-yl)-[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazino]methanone Formula: C16H18N6O6S MolecularWeight: 422.41572

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=NC=CN=C3N)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=NC=CN=C3N)[N+](=O)[O-]

InChI

InChI=1S/C16H18N6O6S/c1-28-13-3-2-11(10-12(13)22(24)25)29(26,27)21-8-6-20(7-9-21)16(23)14-15(17)19-5-4-18-14/h2-5,10H,6-9H2,1H3,(H2,17,19)