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

Systemtic Name: (phenylmethyl) N-[2-(3-acetamidophenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]carbamate Openeye Name: benzyl 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 (phenylmethyl) ester IUPAC Name: benzyl 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 benzyl ester Formula: C23H20N4O3 MolecularWeight: 400.4299

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC(=C1)C2=CC3=CC(=CN=C3N2)NC(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC(=O)NC1=CC=CC(=C1)C2=CC3=CC(=CN=C3N2)NC(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C23H20N4O3/c1-15(28)25-19-9-5-8-17(10-19)21-12-18-11-20(13-24-22(18)27-21)26-23(29)30-14-16-6-3-2-4-7-16/h2-13H,14H2,1H3,(H,24,27)(H,25,28)(H,26,29)