1-(3-chloranyl-4-methyl-phenyl)-N-(2,5-dimethoxyphenyl)pyrazolo[3,4-d]pyrimidin-4-amine

Systemtic Name: 1-(3-chloranyl-4-methyl-phenyl)-N-(2,5-dimethoxyphenyl)pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: 1-(3-chloro-4-methyl-phenyl)-N-(2,5-dimethoxyphenyl)pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: 1-(3-chloro-4-methylphenyl)-N-(2,5-dimethoxyphenyl)-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: 1-(3-chloro-4-methylphenyl)-N-(2,5-dimethoxyphenyl)pyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: [1-(3-chloro-4-methyl-phenyl)pyrazolo[3,4-d]pyrimidin-4-yl]-(2,5-dimethoxyphenyl)amine Formula: C20H18ClN5O2 MolecularWeight: 395.84222

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C3=C(C=N2)C(=NC=N3)NC4=C(C=CC(=C4)OC)OC)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)N2C3=C(C=N2)C(=NC=N3)NC4=C(C=CC(=C4)OC)OC)Cl

InChI

InChI=1S/C20H18ClN5O2/c1-12-4-5-13(8-16(12)21)26-20-15(10-24-26)19(22-11-23-20)25-17-9-14(27-2)6-7-18(17)28-3/h4-11H,1-3H3,(H,22,23,25)