2-(4-azanyl-3-methoxy-phenyl)-7-(oxan-4-yl)pyrrolo[2,3-d]pyrimidin-4-amine

Systemtic Name: 2-(4-azanyl-3-methoxy-phenyl)-7-(oxan-4-yl)pyrrolo[2,3-d]pyrimidin-4-amine Openeye Name: 2-(4-amino-3-methoxy-phenyl)-7-tetrahydropyran-4-yl-pyrrolo[2,3-d]pyrimidin-4-amine CAS Name: 2-(4-amino-3-methoxyphenyl)-7-(4-oxanyl)-4-pyrrolo[2,3-d]pyrimidinamine IUPAC Name: 2-(4-amino-3-methoxyphenyl)-7-(oxan-4-yl)pyrrolo[2,3-d]pyrimidin-4-amine Traditional Name: [2-(4-amino-3-methoxy-phenyl)-7-tetrahydropyran-4-yl-pyrrolo[2,3-d]pyrimidin-4-yl]amine Formula: C18H21N5O2 MolecularWeight: 339.39164

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C2=NC3=C(C=CN3C4CCOCC4)C(=N2)N)N

Isomeric SMILES

COC1=C(C=CC(=C1)C2=NC3=C(C=CN3C4CCOCC4)C(=N2)N)N

InChI

InChI=1S/C18H21N5O2/c1-24-15-10-11(2-3-14(15)19)17-21-16(20)13-4-7-23(18(13)22-17)12-5-8-25-9-6-12/h2-4,7,10,12H,5-6,8-9,19H2,1H3,(H2,20,21,22)