(2R)-2-azanyl-5-[[6-[(5-cyanopyrazin-2-yl)amino]pyrimidin-4-yl]amino]-N-phenyl-pentanamide

Systemtic Name: (2R)-2-azanyl-5-[[6-[(5-cyanopyrazin-2-yl)amino]pyrimidin-4-yl]amino]-N-phenyl-pentanamide Openeye Name: (2R)-2-amino-5-[[6-[(5-cyanopyrazin-2-yl)amino]pyrimidin-4-yl]amino]-N-phenyl-pentanamide CAS Name: (2R)-2-amino-5-[[6-[(5-cyano-2-pyrazinyl)amino]-4-pyrimidinyl]amino]-N-phenylpentanamide IUPAC Name: (2R)-2-amino-5-[[6-[(5-cyanopyrazin-2-yl)amino]pyrimidin-4-yl]amino]-N-phenylpentanamide Traditional Name: (2R)-2-amino-5-[[6-[(5-cyanopyrazin-2-yl)amino]pyrimidin-4-yl]amino]-N-phenyl-valeramide Formula: C20H21N9O MolecularWeight: 403.44044

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)C(CCCNC2=NC=NC(=C2)NC3=NC=C(N=C3)C#N)N

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)[C@@H](CCCNC2=NC=NC(=C2)NC3=NC=C(N=C3)C#N)N

InChI

InChI=1S/C20H21N9O/c21-10-15-11-25-19(12-24-15)29-18-9-17(26-13-27-18)23-8-4-7-16(22)20(30)28-14-5-2-1-3-6-14/h1-3,5-6,9,11-13,16H,4,7-8,22H2,(H,28,30)(H2,23,25,26,27,29)/t16-/m1/s1