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

Systemtic Name: N-[4-(4-azanyl-7-cyclopentyl-pyrrolo[2,3-d]pyrimidin-5-yl)-2-oxidanyl-phenyl]benzamide Openeye Name: N-[4-(4-amino-7-cyclopentyl-pyrrolo[2,3-d]pyrimidin-5-yl)-2-hydroxy-phenyl]benzamide CAS Name: N-[4-(4-amino-7-cyclopentyl-5-pyrrolo[2,3-d]pyrimidinyl)-2-hydroxyphenyl]benzamide IUPAC Name: N-[4-(4-amino-7-cyclopentylpyrrolo[2,3-d]pyrimidin-5-yl)-2-hydroxyphenyl]benzamide Traditional Name: N-[4-(4-amino-7-cyclopentyl-pyrrolo[2,3-d]pyrimidin-5-yl)-2-hydroxy-phenyl]benzamide Formula: C24H23N5O2 MolecularWeight: 413.47172

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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=CC=C5)O

Isomeric SMILES

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

InChI

InChI=1S/C24H23N5O2/c25-22-21-18(13-29(17-8-4-5-9-17)23(21)27-14-26-22)16-10-11-19(20(30)12-16)28-24(31)15-6-2-1-3-7-15/h1-3,6-7,10-14,17,30H,4-5,8-9H2,(H,28,31)(H2,25,26,27)