N-[(3-chlorophenyl)methyl]-1-(2,4-dimethylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine

Systemtic Name: N-[(3-chlorophenyl)methyl]-1-(2,4-dimethylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: N-[(3-chlorophenyl)methyl]-1-(2,4-dimethylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: N-[(3-chlorophenyl)methyl]-1-(2,4-dimethylphenyl)-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: N-[(3-chlorophenyl)methyl]-1-(2,4-dimethylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: (3-chlorobenzyl)-[1-(2,4-dimethylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]amine Formula: C20H18ClN5 MolecularWeight: 363.84342

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2C3=C(C=N2)C(=NC=N3)NCC4=CC(=CC=C4)Cl)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2C3=C(C=N2)C(=NC=N3)NCC4=CC(=CC=C4)Cl)C

InChI

InChI=1S/C20H18ClN5/c1-13-6-7-18(14(2)8-13)26-20-17(11-25-26)19(23-12-24-20)22-10-15-4-3-5-16(21)9-15/h3-9,11-12H,10H2,1-2H3,(H,22,23,24)