N-[4-(4-azanyl-7-cyclopentyl-pyrrolo[2,3-d]pyrimidin-5-yl)-2-oxidanyl-phenyl]-4-chloranyl-benzamide

Systemtic Name: N-[4-(4-azanyl-7-cyclopentyl-pyrrolo[2,3-d]pyrimidin-5-yl)-2-oxidanyl-phenyl]-4-chloranyl-benzamide Openeye Name: N-[4-(4-amino-7-cyclopentyl-pyrrolo[2,3-d]pyrimidin-5-yl)-2-hydroxy-phenyl]-4-chloro-benzamide CAS Name: N-[4-(4-amino-7-cyclopentyl-5-pyrrolo[2,3-d]pyrimidinyl)-2-hydroxyphenyl]-4-chlorobenzamide IUPAC Name: N-[4-(4-amino-7-cyclopentylpyrrolo[2,3-d]pyrimidin-5-yl)-2-hydroxyphenyl]-4-chlorobenzamide Traditional Name: N-[4-(4-amino-7-cyclopentyl-pyrrolo[2,3-d]pyrimidin-5-yl)-2-hydroxy-phenyl]-4-chloro-benzamide Formula: C24H22ClN5O2 MolecularWeight: 447.91678

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C=C(C3=C2N=CN=C3N)C4=CC(=C(C=C4)NC(=O)C5=CC=C(C=C5)Cl)O

Isomeric SMILES

C1CCC(C1)N2C=C(C3=C2N=CN=C3N)C4=CC(=C(C=C4)NC(=O)C5=CC=C(C=C5)Cl)O

InChI

InChI=1S/C24H22ClN5O2/c25-16-8-5-14(6-9-16)24(32)29-19-10-7-15(11-20(19)31)18-12-30(17-3-1-2-4-17)23-21(18)22(26)27-13-28-23/h5-13,17,31H,1-4H2,(H,29,32)(H2,26,27,28)