1-[3-[2-(cyclohexylamino)pyrimidin-4-yl]pyrrolo[2,3-b]pyridin-1-yl]ethanone

Systemtic Name: 1-[3-[2-(cyclohexylamino)pyrimidin-4-yl]pyrrolo[2,3-b]pyridin-1-yl]ethanone Openeye Name: 1-[3-[2-(cyclohexylamino)pyrimidin-4-yl]pyrrolo[2,3-b]pyridin-1-yl]ethanone CAS Name: 1-[3-[2-(cyclohexylamino)-4-pyrimidinyl]-1-pyrrolo[2,3-b]pyridinyl]ethanone IUPAC Name: 1-[3-[2-(cyclohexylamino)pyrimidin-4-yl]pyrrolo[2,3-b]pyridin-1-yl]ethanone Traditional Name: 1-[3-[2-(cyclohexylamino)pyrimidin-4-yl]pyrrolo[2,3-b]pyridin-1-yl]ethanone Formula: C19H21N5O MolecularWeight: 335.40294

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C=C(C2=C1N=CC=C2)C3=NC(=NC=C3)NC4CCCCC4

Isomeric SMILES

CC(=O)N1C=C(C2=C1N=CC=C2)C3=NC(=NC=C3)NC4CCCCC4

InChI

InChI=1S/C19H21N5O/c1-13(25)24-12-16(15-8-5-10-20-18(15)24)17-9-11-21-19(23-17)22-14-6-3-2-4-7-14/h5,8-12,14H,2-4,6-7H2,1H3,(H,21,22,23)