4-[4-(5-morpholin-4-ylsulfonylpyridin-2-yl)piperazin-1-yl]-3-nitro-benzamide

Systemtic Name: 4-[4-(5-morpholin-4-ylsulfonylpyridin-2-yl)piperazin-1-yl]-3-nitro-benzamide Openeye Name: 4-[4-(5-morpholinosulfonyl-2-pyridyl)piperazin-1-yl]-3-nitro-benzamide CAS Name: 4-[4-[5-(4-morpholinylsulfonyl)-2-pyridinyl]-1-piperazinyl]-3-nitrobenzamide IUPAC Name: 4-[4-(5-morpholin-4-ylsulfonylpyridin-2-yl)piperazin-1-yl]-3-nitrobenzamide Traditional Name: 4-[4-(5-morpholinosulfonyl-2-pyridyl)piperazino]-3-nitro-benzamide Formula: C20H24N6O6S MolecularWeight: 476.50616

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-])C3=NC=C(C=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

C1CN(CCN1C2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-])C3=NC=C(C=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C20H24N6O6S/c21-20(27)15-1-3-17(18(13-15)26(28)29)23-5-7-24(8-6-23)19-4-2-16(14-22-19)33(30,31)25-9-11-32-12-10-25/h1-4,13-14H,5-12H2,(H2,21,27)