1-morpholin-4-yl-2-[4-(1H-pyrrolo[2,3-b]pyridin-3-ylsulfonyl)piperazin-1-yl]ethane-1,2-dione

Systemtic Name: 1-morpholin-4-yl-2-[4-(1H-pyrrolo[2,3-b]pyridin-3-ylsulfonyl)piperazin-1-yl]ethane-1,2-dione Openeye Name: 1-morpholino-2-[4-(1H-pyrrolo[2,3-b]pyridin-3-ylsulfonyl)piperazin-1-yl]ethane-1,2-dione CAS Name: 1-(4-morpholinyl)-2-[4-(1H-pyrrolo[2,3-b]pyridin-3-ylsulfonyl)-1-piperazinyl]ethane-1,2-dione IUPAC Name: 1-morpholin-4-yl-2-[4-(1H-pyrrolo[2,3-b]pyridin-3-ylsulfonyl)piperazin-1-yl]ethane-1,2-dione Traditional Name: 1-morpholino-2-[4-(1H-pyrrolo[2,3-b]pyridin-3-ylsulfonyl)piperazino]ethane-1,2-dione Formula: C17H21N5O5S MolecularWeight: 407.44414

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C(=O)N2CCOCC2)S(=O)(=O)C3=CNC4=C3C=CC=N4

Isomeric SMILES

C1CN(CCN1C(=O)C(=O)N2CCOCC2)S(=O)(=O)C3=CNC4=C3C=CC=N4

InChI

InChI=1S/C17H21N5O5S/c23-16(17(24)21-8-10-27-11-9-21)20-4-6-22(7-5-20)28(25,26)14-12-19-15-13(14)2-1-3-18-15/h1-3,12H,4-11H2,(H,18,19)