[2-tert-butyl-4-[(5-methylpyrazin-2-yl)amino]phenyl] 3,3-dimethylbutanoate

Systemtic Name: [2-tert-butyl-4-[(5-methylpyrazin-2-yl)amino]phenyl] 3,3-dimethylbutanoate Openeye Name: [2-tert-butyl-4-[(5-methylpyrazin-2-yl)amino]phenyl] 3,3-dimethylbutanoate CAS Name: 3,3-dimethylbutanoic acid [2-tert-butyl-4-[(5-methyl-2-pyrazinyl)amino]phenyl] ester IUPAC Name: [2-tert-butyl-4-[(5-methylpyrazin-2-yl)amino]phenyl] 3,3-dimethylbutanoate Traditional Name: 3,3-dimethylbutyric acid [2-tert-butyl-4-[(5-methylpyrazin-2-yl)amino]phenyl] ester Formula: C21H29N3O2 MolecularWeight: 355.47386

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C=N1)NC2=CC(=C(C=C2)OC(=O)CC(C)(C)C)C(C)(C)C

Isomeric SMILES

CC1=CN=C(C=N1)NC2=CC(=C(C=C2)OC(=O)CC(C)(C)C)C(C)(C)C

InChI

InChI=1S/C21H29N3O2/c1-14-12-23-18(13-22-14)24-15-8-9-17(16(10-15)21(5,6)7)26-19(25)11-20(2,3)4/h8-10,12-13H,11H2,1-7H3,(H,23,24)