2-[3-[4-azanyl-5-(3-methoxyphenyl)pyrrolo[2,3-d]pyrimidin-7-yl]pyrrolidin-1-yl]ethanamide

Systemtic Name: 2-[3-[4-azanyl-5-(3-methoxyphenyl)pyrrolo[2,3-d]pyrimidin-7-yl]pyrrolidin-1-yl]ethanamide Openeye Name: 2-[3-[4-amino-5-(3-methoxyphenyl)pyrrolo[2,3-d]pyrimidin-7-yl]pyrrolidin-1-yl]acetamide CAS Name: 2-[3-[4-amino-5-(3-methoxyphenyl)-7-pyrrolo[2,3-d]pyrimidinyl]-1-pyrrolidinyl]acetamide IUPAC Name: 2-[3-[4-amino-5-(3-methoxyphenyl)pyrrolo[2,3-d]pyrimidin-7-yl]pyrrolidin-1-yl]acetamide Traditional Name: 2-[3-[4-amino-5-(3-methoxyphenyl)pyrrolo[2,3-d]pyrimidin-7-yl]pyrrolidino]acetamide Formula: C19H22N6O2 MolecularWeight: 366.41698

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=CN(C3=C2C(=NC=N3)N)C4CCN(C4)CC(=O)N

Isomeric SMILES

COC1=CC=CC(=C1)C2=CN(C3=C2C(=NC=N3)N)C4CCN(C4)CC(=O)N

InChI

InChI=1S/C19H22N6O2/c1-27-14-4-2-3-12(7-14)15-9-25(19-17(15)18(21)22-11-23-19)13-5-6-24(8-13)10-16(20)26/h2-4,7,9,11,13H,5-6,8,10H2,1H3,(H2,20,26)(H2,21,22,23)