[3-methyl-4-(1H-pyrrolo[2,3-b]pyridin-3-ylsulfonyl)piperazin-1-yl]-quinoxalin-2-yl-methanone

Systemtic Name: [3-methyl-4-(1H-pyrrolo[2,3-b]pyridin-3-ylsulfonyl)piperazin-1-yl]-quinoxalin-2-yl-methanone Openeye Name: [3-methyl-4-(1H-pyrrolo[2,3-b]pyridin-3-ylsulfonyl)piperazin-1-yl]-quinoxalin-2-yl-methanone CAS Name: [3-methyl-4-(1H-pyrrolo[2,3-b]pyridin-3-ylsulfonyl)-1-piperazinyl]-(2-quinoxalinyl)methanone IUPAC Name: [3-methyl-4-(1H-pyrrolo[2,3-b]pyridin-3-ylsulfonyl)piperazin-1-yl]-quinoxalin-2-ylmethanone Traditional Name: [3-methyl-4-(1H-pyrrolo[2,3-b]pyridin-3-ylsulfonyl)piperazino]-quinoxalin-2-yl-methanone Formula: C21H20N6O3S MolecularWeight: 436.4869

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1S(=O)(=O)C2=CNC3=C2C=CC=N3)C(=O)C4=NC5=CC=CC=C5N=C4

Isomeric SMILES

CC1CN(CCN1S(=O)(=O)C2=CNC3=C2C=CC=N3)C(=O)C4=NC5=CC=CC=C5N=C4

InChI

InChI=1S/C21H20N6O3S/c1-14-13-26(21(28)18-11-23-16-6-2-3-7-17(16)25-18)9-10-27(14)31(29,30)19-12-24-20-15(19)5-4-8-22-20/h2-8,11-12,14H,9-10,13H2,1H3,(H,22,24)