(2S)-2-[(5,6-dimethyl-2-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]-4-methyl-pentan-1-ol

Systemtic Name: (2S)-2-[(5,6-dimethyl-2-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]-4-methyl-pentan-1-ol Openeye Name: (2S)-2-[(5,6-dimethyl-2-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]-4-methyl-pentan-1-ol CAS Name: (2S)-2-[(5,6-dimethyl-2-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]-4-methyl-1-pentanol IUPAC Name: (2S)-2-[(5,6-dimethyl-2-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]-4-methylpentan-1-ol Traditional Name: (2S)-2-[(5,6-dimethyl-2-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]-4-methyl-pentan-1-ol Formula: C20H26N4O MolecularWeight: 338.44664

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC2=C1C(=NC(=N2)C3=CC=CC=C3)NC(CC(C)C)CO)C

Isomeric SMILES

CC1=C(NC2=C1C(=NC(=N2)C3=CC=CC=C3)N[C@@H](CC(C)C)CO)C

InChI

InChI=1S/C20H26N4O/c1-12(2)10-16(11-25)22-20-17-13(3)14(4)21-19(17)23-18(24-20)15-8-6-5-7-9-15/h5-9,12,16,25H,10-11H2,1-4H3,(H2,21,22,23,24)/t16-/m0/s1