N-[4-[(3R)-3-azanylpiperidin-1-yl]-5-bromanyl-1H-pyrrolo[2,3-b]pyridin-3-yl]-5-methyl-1,2-oxazole-3-carboxamide

Systemtic Name: N-[4-[(3R)-3-azanylpiperidin-1-yl]-5-bromanyl-1H-pyrrolo[2,3-b]pyridin-3-yl]-5-methyl-1,2-oxazole-3-carboxamide Openeye Name: N-[4-[(3R)-3-amino-1-piperidyl]-5-bromo-1H-pyrrolo[2,3-b]pyridin-3-yl]-5-methyl-isoxazole-3-carboxamide CAS Name: N-[4-[(3R)-3-amino-1-piperidinyl]-5-bromo-1H-pyrrolo[2,3-b]pyridin-3-yl]-5-methyl-3-isoxazolecarboxamide IUPAC Name: N-[4-[(3R)-3-aminopiperidin-1-yl]-5-bromo-1H-pyrrolo[2,3-b]pyridin-3-yl]-5-methyl-1,2-oxazole-3-carboxamide Traditional Name: N-[4-[(3R)-3-aminopiperidino]-5-bromo-1H-pyrrolo[2,3-b]pyridin-3-yl]-5-methyl-isoxazole-3-carboxamide Formula: C17H19BrN6O2 MolecularWeight: 419.27576

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)C(=O)NC2=CNC3=NC=C(C(=C23)N4CCCC(C4)N)Br

Isomeric SMILES

CC1=CC(=NO1)C(=O)NC2=CNC3=NC=C(C(=C23)N4CCC[C@H](C4)N)Br

InChI

InChI=1S/C17H19BrN6O2/c1-9-5-12(23-26-9)17(25)22-13-7-21-16-14(13)15(11(18)6-20-16)24-4-2-3-10(19)8-24/h5-7,10H,2-4,8,19H2,1H3,(H,20,21)(H,22,25)/t10-/m1/s1