N-[4-(4-pyrazin-2-ylpiperazin-1-yl)sulfonylphenyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[4-(4-pyrazin-2-ylpiperazin-1-yl)sulfonylphenyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[4-(4-pyrazin-2-ylpiperazin-1-yl)sulfonylphenyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[4-[[4-(2-pyrazinyl)-1-piperazinyl]sulfonyl]phenyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[4-(4-pyrazin-2-ylpiperazin-1-yl)sulfonylphenyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[4-(4-pyrazin-2-ylpiperazino)sulfonylphenyl]-piperonylamide Formula: C22H21N5O5S MolecularWeight: 467.49764

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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=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CN(CCN1C2=NC=CN=C2)S(=O)(=O)C3=CC=C(C=C3)NC(=O)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C22H21N5O5S/c28-22(16-1-6-19-20(13-16)32-15-31-19)25-17-2-4-18(5-3-17)33(29,30)27-11-9-26(10-12-27)21-14-23-7-8-24-21/h1-8,13-14H,9-12,15H2,(H,25,28)