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

Systemtic Name: N-[4-(4-azanyl-7-propan-2-yl-pyrrolo[2,3-d]pyrimidin-5-yl)phenyl]benzamide Openeye Name: N-[4-(4-amino-7-isopropyl-pyrrolo[2,3-d]pyrimidin-5-yl)phenyl]benzamide CAS Name: N-[4-(4-amino-7-propan-2-yl-5-pyrrolo[2,3-d]pyrimidinyl)phenyl]benzamide IUPAC Name: N-[4-(4-amino-7-propan-2-ylpyrrolo[2,3-d]pyrimidin-5-yl)phenyl]benzamide Traditional Name: N-[4-(4-amino-7-isopropyl-pyrrolo[2,3-d]pyrimidin-5-yl)phenyl]benzamide Formula: C22H21N5O MolecularWeight: 371.43504

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=C(C2=C1N=CN=C2N)C3=CC=C(C=C3)NC(=O)C4=CC=CC=C4

Isomeric SMILES

CC(C)N1C=C(C2=C1N=CN=C2N)C3=CC=C(C=C3)NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H21N5O/c1-14(2)27-12-18(19-20(23)24-13-25-21(19)27)15-8-10-17(11-9-15)26-22(28)16-6-4-3-5-7-16/h3-14H,1-2H3,(H,26,28)(H2,23,24,25)