3-[2-(4-ethanoyl-1,4-diazepan-1-yl)pyrimidin-4-yl]-1H-pyrrolo[2,3-b]pyridine-5-carboxamide

Systemtic Name: 3-[2-(4-ethanoyl-1,4-diazepan-1-yl)pyrimidin-4-yl]-1H-pyrrolo[2,3-b]pyridine-5-carboxamide Openeye Name: 3-[2-(4-acetyl-1,4-diazepan-1-yl)pyrimidin-4-yl]-1H-pyrrolo[2,3-b]pyridine-5-carboxamide CAS Name: 3-[2-(4-acetyl-1,4-diazepan-1-yl)-4-pyrimidinyl]-1H-pyrrolo[2,3-b]pyridine-5-carboxamide IUPAC Name: 3-[2-(4-acetyl-1,4-diazepan-1-yl)pyrimidin-4-yl]-1H-pyrrolo[2,3-b]pyridine-5-carboxamide Traditional Name: 3-[2-(4-acetyl-1,4-diazepan-1-yl)pyrimidin-4-yl]-1H-pyrrolo[2,3-b]pyridine-5-carboxamide Formula: C19H21N7O2 MolecularWeight: 379.41574

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCCN(CC1)C2=NC=CC(=N2)C3=CNC4=NC=C(C=C34)C(=O)N

Isomeric SMILES

CC(=O)N1CCCN(CC1)C2=NC=CC(=N2)C3=CNC4=NC=C(C=C34)C(=O)N

InChI

InChI=1S/C19H21N7O2/c1-12(27)25-5-2-6-26(8-7-25)19-21-4-3-16(24-19)15-11-23-18-14(15)9-13(10-22-18)17(20)28/h3-4,9-11H,2,5-8H2,1H3,(H2,20,28)(H,22,23)