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

Systemtic Name: [(3R)-3-methyl-4-(1H-pyrrolo[2,3-b]pyridin-3-ylsulfonyl)piperazin-1-yl]-pyrazin-2-yl-methanone Openeye Name: [(3R)-3-methyl-4-(1H-pyrrolo[2,3-b]pyridin-3-ylsulfonyl)piperazin-1-yl]-pyrazin-2-yl-methanone CAS Name: [(3R)-3-methyl-4-(1H-pyrrolo[2,3-b]pyridin-3-ylsulfonyl)-1-piperazinyl]-(2-pyrazinyl)methanone IUPAC Name: [(3R)-3-methyl-4-(1H-pyrrolo[2,3-b]pyridin-3-ylsulfonyl)piperazin-1-yl]-pyrazin-2-ylmethanone Traditional Name: [(3R)-3-methyl-4-(1H-pyrrolo[2,3-b]pyridin-3-ylsulfonyl)piperazino]-pyrazin-2-yl-methanone Formula: C17H18N6O3S MolecularWeight: 386.42822

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1S(=O)(=O)C2=CNC3=C2C=CC=N3)C(=O)C4=NC=CN=C4

Isomeric SMILES

C[C@@H]1CN(CCN1S(=O)(=O)C2=CNC3=C2C=CC=N3)C(=O)C4=NC=CN=C4

InChI

InChI=1S/C17H18N6O3S/c1-12-11-22(17(24)14-9-18-5-6-19-14)7-8-23(12)27(25,26)15-10-21-16-13(15)3-2-4-20-16/h2-6,9-10,12H,7-8,11H2,1H3,(H,20,21)/t12-/m1/s1