1-[4-[2-[3,6-bis(2-methylpropyl)pyrazin-2-yl]ethynyl]phenyl]ethanone

Systemtic Name: 1-[4-[2-[3,6-bis(2-methylpropyl)pyrazin-2-yl]ethynyl]phenyl]ethanone Openeye Name: 1-[4-[2-(3,6-diisobutylpyrazin-2-yl)ethynyl]phenyl]ethanone CAS Name: 1-[4-[2-[3,6-bis(2-methylpropyl)-2-pyrazinyl]ethynyl]phenyl]ethanone IUPAC Name: 1-[4-[2-[3,6-bis(2-methylpropyl)pyrazin-2-yl]ethynyl]phenyl]ethanone Traditional Name: 1-[4-[2-(3,6-diisobutylpyrazin-2-yl)ethynyl]phenyl]ethanone Formula: C22H26N2O MolecularWeight: 334.45464

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CN=C(C(=N1)C#CC2=CC=C(C=C2)C(=O)C)CC(C)C

Isomeric SMILES

CC(C)CC1=CN=C(C(=N1)C#CC2=CC=C(C=C2)C(=O)C)CC(C)C

InChI

InChI=1S/C22H26N2O/c1-15(2)12-20-14-23-22(13-16(3)4)21(24-20)11-8-18-6-9-19(10-7-18)17(5)25/h6-7,9-10,14-16H,12-13H2,1-5H3