5-[(2-methyl-6-phenyl-5H-pyrrolo[3,2-d]pyrimidin-4-yl)amino]-2-phenyl-pentanoate

Systemtic Name: 5-[(2-methyl-6-phenyl-5H-pyrrolo[3,2-d]pyrimidin-4-yl)amino]-2-phenyl-pentanoate Openeye Name: 5-[(2-methyl-6-phenyl-5H-pyrrolo[3,2-d]pyrimidin-4-yl)amino]-2-phenyl-pentanoate CAS Name: 5-[(2-methyl-6-phenyl-5H-pyrrolo[3,2-d]pyrimidin-4-yl)amino]-2-phenylpentanoate IUPAC Name: 5-[(2-methyl-6-phenyl-5H-pyrrolo[3,2-d]pyrimidin-4-yl)amino]-2-phenylpentanoate Traditional Name: 5-[(2-methyl-6-phenyl-5H-pyrrolo[3,2-d]pyrimidin-4-yl)amino]-2-phenyl-valerate Formula: C24H23N4O2- MolecularWeight: 399.46502

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=N1)NCCCC(C3=CC=CC=C3)C(=O)[O-])NC(=C2)C4=CC=CC=C4

Isomeric SMILES

CC1=NC2=C(C(=N1)NCCCC(C3=CC=CC=C3)C(=O)[O-])NC(=C2)C4=CC=CC=C4

InChI

InChI=1S/C24H24N4O2/c1-16-26-21-15-20(18-11-6-3-7-12-18)28-22(21)23(27-16)25-14-8-13-19(24(29)30)17-9-4-2-5-10-17/h2-7,9-12,15,19,28H,8,13-14H2,1H3,(H,29,30)(H,25,26,27)/p-1