tert-butyl N-[4-[4-chloranyl-7-(oxan-4-yl)pyrrolo[2,3-d]pyrimidin-5-yl]-2-methoxy-phenyl]carbamate

Systemtic Name: tert-butyl N-[4-[4-chloranyl-7-(oxan-4-yl)pyrrolo[2,3-d]pyrimidin-5-yl]-2-methoxy-phenyl]carbamate Openeye Name: tert-butyl N-[4-(4-chloro-7-tetrahydropyran-4-yl-pyrrolo[2,3-d]pyrimidin-5-yl)-2-methoxy-phenyl]carbamate CAS Name: N-[4-[4-chloro-7-(4-oxanyl)-5-pyrrolo[2,3-d]pyrimidinyl]-2-methoxyphenyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-[4-chloro-7-(oxan-4-yl)pyrrolo[2,3-d]pyrimidin-5-yl]-2-methoxyphenyl]carbamate Traditional Name: N-[4-(4-chloro-7-tetrahydropyran-4-yl-pyrrolo[2,3-d]pyrimidin-5-yl)-2-methoxy-phenyl]carbamic acid tert-butyl ester Formula: C23H27ClN4O4 MolecularWeight: 458.93788

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=C(C=C(C=C1)C2=CN(C3=C2C(=NC=N3)Cl)C4CCOCC4)OC

Isomeric SMILES

CC(C)(C)OC(=O)NC1=C(C=C(C=C1)C2=CN(C3=C2C(=NC=N3)Cl)C4CCOCC4)OC

InChI

InChI=1S/C23H27ClN4O4/c1-23(2,3)32-22(29)27-17-6-5-14(11-18(17)30-4)16-12-28(15-7-9-31-10-8-15)21-19(16)20(24)25-13-26-21/h5-6,11-13,15H,7-10H2,1-4H3,(H,27,29)