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

Systemtic Name: 1-(3-chloranyl-4-methyl-phenyl)-N-(furan-2-ylmethyl)pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: 1-(3-chloro-4-methyl-phenyl)-N-(2-furylmethyl)pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: 1-(3-chloro-4-methylphenyl)-N-(2-furanylmethyl)-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: 1-(3-chloro-4-methylphenyl)-N-(furan-2-ylmethyl)pyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: [1-(3-chloro-4-methyl-phenyl)pyrazolo[3,4-d]pyrimidin-4-yl]-(2-furfuryl)amine Formula: C17H14ClN5O MolecularWeight: 339.77896

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C3=C(C=N2)C(=NC=N3)NCC4=CC=CO4)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)N2C3=C(C=N2)C(=NC=N3)NCC4=CC=CO4)Cl

InChI

InChI=1S/C17H14ClN5O/c1-11-4-5-12(7-15(11)18)23-17-14(9-22-23)16(20-10-21-17)19-8-13-3-2-6-24-13/h2-7,9-10H,8H2,1H3,(H,19,20,21)