tert-butyl N-[4-(4-chloranyl-7-cyclopentyl-1H-pyrrolo[2,3-d]pyrimidin-4-yl)-2-methoxy-phenyl]carbamate

Systemtic Name: tert-butyl N-[4-(4-chloranyl-7-cyclopentyl-1H-pyrrolo[2,3-d]pyrimidin-4-yl)-2-methoxy-phenyl]carbamate Openeye Name: tert-butyl N-[4-(4-chloro-7-cyclopentyl-1H-pyrrolo[2,3-d]pyrimidin-4-yl)-2-methoxy-phenyl]carbamate CAS Name: N-[4-(4-chloro-7-cyclopentyl-1H-pyrrolo[2,3-d]pyrimidin-4-yl)-2-methoxyphenyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-(4-chloro-7-cyclopentyl-1H-pyrrolo[2,3-d]pyrimidin-4-yl)-2-methoxyphenyl]carbamate Traditional Name: N-[4-(4-chloro-7-cyclopentyl-1H-pyrrolo[2,3-d]pyrimidin-4-yl)-2-methoxy-phenyl]carbamic acid tert-butyl ester Formula: C23H29ClN4O3 MolecularWeight: 444.95436

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=C(C=C(C=C1)C2(C3=C(NC=N2)N(C=C3)C4CCCC4)Cl)OC

Isomeric SMILES

CC(C)(C)OC(=O)NC1=C(C=C(C=C1)C2(C3=C(NC=N2)N(C=C3)C4CCCC4)Cl)OC

InChI

InChI=1S/C23H29ClN4O3/c1-22(2,3)31-21(29)27-18-10-9-15(13-19(18)30-4)23(24)17-11-12-28(16-7-5-6-8-16)20(17)25-14-26-23/h9-14,16H,5-8H2,1-4H3,(H,25,26)(H,27,29)