2-[5-[(2R,5S)-4-[(4-fluorophenyl)methyl]-2,5-dimethyl-piperazin-1-yl]carbonyl-6-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl]-N,N-dimethyl-2-oxidanylidene-ethanamide

Systemtic Name: 2-[5-[(2R,5S)-4-[(4-fluorophenyl)methyl]-2,5-dimethyl-piperazin-1-yl]carbonyl-6-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl]-N,N-dimethyl-2-oxidanylidene-ethanamide Openeye Name: 2-[5-[(2R,5S)-4-[(4-fluorophenyl)methyl]-2,5-dimethyl-piperazine-1-carbonyl]-6-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl]-N,N-dimethyl-2-oxo-acetamide CAS Name: 2-[5-[[(2R,5S)-4-[(4-fluorophenyl)methyl]-2,5-dimethyl-1-piperazinyl]-oxomethyl]-6-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl]-N,N-dimethyl-2-oxoacetamide IUPAC Name: 2-[5-[(2R,5S)-4-[(4-fluorophenyl)methyl]-2,5-dimethylpiperazine-1-carbonyl]-6-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl]-N,N-dimethyl-2-oxoacetamide Traditional Name: 2-[5-[(2R,5S)-4-(4-fluorobenzyl)-2,5-dimethyl-piperazine-1-carbonyl]-6-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl]-2-keto-N,N-dimethyl-acetamide Formula: C26H30FN5O4 MolecularWeight: 495.545903

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(C(CN1C(=O)C2=C(N=C3C(=C2)C(=CN3)C(=O)C(=O)N(C)C)OC)C)CC4=CC=C(C=C4)F

Isomeric SMILES

C[C@@H]1CN([C@H](CN1C(=O)C2=C(N=C3C(=C2)C(=CN3)C(=O)C(=O)N(C)C)OC)C)CC4=CC=C(C=C4)F

InChI

InChI=1S/C26H30FN5O4/c1-15-13-32(16(2)12-31(15)14-17-6-8-18(27)9-7-17)25(34)20-10-19-21(22(33)26(35)30(3)4)11-28-23(19)29-24(20)36-5/h6-11,15-16H,12-14H2,1-5H3,(H,28,29)/t15-,16+/m0/s1