3,3-dimethyl-1-[2-(3-pyrrolidin-1-ylphenyl)-5H-pyrrolo[2,3-b]pyrazin-7-yl]butan-1-one

Systemtic Name: 3,3-dimethyl-1-[2-(3-pyrrolidin-1-ylphenyl)-5H-pyrrolo[2,3-b]pyrazin-7-yl]butan-1-one Openeye Name: 3,3-dimethyl-1-[2-(3-pyrrolidin-1-ylphenyl)-5H-pyrrolo[2,3-b]pyrazin-7-yl]butan-1-one CAS Name: 3,3-dimethyl-1-[2-[3-(1-pyrrolidinyl)phenyl]-5H-pyrrolo[2,3-b]pyrazin-7-yl]-1-butanone IUPAC Name: 3,3-dimethyl-1-[2-(3-pyrrolidin-1-ylphenyl)-5H-pyrrolo[2,3-b]pyrazin-7-yl]butan-1-one Traditional Name: 3,3-dimethyl-1-[2-(3-pyrrolidinophenyl)-5H-pyrrolo[2,3-b]pyrazin-7-yl]butan-1-one Formula: C22H26N4O MolecularWeight: 362.46804

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=O)C1=CNC2=NC=C(N=C12)C3=CC(=CC=C3)N4CCCC4

Isomeric SMILES

CC(C)(C)CC(=O)C1=CNC2=NC=C(N=C12)C3=CC(=CC=C3)N4CCCC4

InChI

InChI=1S/C22H26N4O/c1-22(2,3)12-19(27)17-13-23-21-20(17)25-18(14-24-21)15-7-6-8-16(11-15)26-9-4-5-10-26/h6-8,11,13-14H,4-5,9-10,12H2,1-3H3,(H,23,24)