2,2-dimethylpropyl N-[2-(3-acetamidophenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]carbamate

Systemtic Name: 2,2-dimethylpropyl N-[2-(3-acetamidophenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]carbamate Openeye Name: 2,2-dimethylpropyl N-[2-(3-acetamidophenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]carbamate CAS Name: N-[2-(3-acetamidophenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]carbamic acid 2,2-dimethylpropyl ester IUPAC Name: 2,2-dimethylpropyl N-[2-(3-acetamidophenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]carbamate Traditional Name: N-[2-(3-acetamidophenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]carbamic acid neopentyl ester Formula: C21H24N4O3 MolecularWeight: 380.44026

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC(=C1)C2=CC3=CC(=CN=C3N2)NC(=O)OCC(C)(C)C

Isomeric SMILES

CC(=O)NC1=CC=CC(=C1)C2=CC3=CC(=CN=C3N2)NC(=O)OCC(C)(C)C

InChI

InChI=1S/C21H24N4O3/c1-13(26)23-16-7-5-6-14(8-16)18-10-15-9-17(11-22-19(15)25-18)24-20(27)28-12-21(2,3)4/h5-11H,12H2,1-4H3,(H,22,25)(H,23,26)(H,24,27)