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

Systemtic Name: N-(3-ethynylphenyl)-5-methyl-7H-pyrrolo[2,3-d]pyrimidin-4-amine hydrochloride Openeye Name: N-(3-ethynylphenyl)-5-methyl-7H-pyrrolo[2,3-d]pyrimidin-4-amine hydrochloride CAS Name: N-(3-ethynylphenyl)-5-methyl-7H-pyrrolo[2,3-d]pyrimidin-4-amine hydrochloride IUPAC Name: N-(3-ethynylphenyl)-5-methyl-7H-pyrrolo[2,3-d]pyrimidin-4-amine hydrochloride Traditional Name: (3-ethynylphenyl)-(5-methyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)amine hydrochloride Formula: C15H13ClN4 MolecularWeight: 284.74352

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CNC2=C1C(=NC=N2)NC3=CC=CC(=C3)C#C.Cl

Isomeric SMILES

CC1=CNC2=C1C(=NC=N2)NC3=CC=CC(=C3)C#C.Cl

InChI

InChI=1S/C15H12N4.ClH/c1-3-11-5-4-6-12(7-11)19-15-13-10(2)8-16-14(13)17-9-18-15;/h1,4-9H,2H3,(H2,16,17,18,19);1H