5-chloranyl-N-(3-ethynylphenyl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine

Systemtic Name: 5-chloranyl-N-(3-ethynylphenyl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine Openeye Name: 5-chloro-N-(3-ethynylphenyl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine CAS Name: 5-chloro-N-(3-ethynylphenyl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine IUPAC Name: 5-chloro-N-(3-ethynylphenyl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine Traditional Name: (5-chloro-7H-pyrrolo[2,3-d]pyrimidin-4-yl)-(3-ethynylphenyl)amine Formula: C14H9ClN4 MolecularWeight: 268.70106

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC(=CC=C1)NC2=NC=NC3=C2C(=CN3)Cl

Isomeric SMILES

C#CC1=CC(=CC=C1)NC2=NC=NC3=C2C(=CN3)Cl

InChI

InChI=1S/C14H9ClN4/c1-2-9-4-3-5-10(6-9)19-14-12-11(15)7-16-13(12)17-8-18-14/h1,3-8H,(H2,16,17,18,19)