N-(3-methoxyphenyl)-6-methyl-1-phenethyl-pyrazolo[3,4-d]pyrimidin-4-amine

Systemtic Name: N-(3-methoxyphenyl)-6-methyl-1-phenethyl-pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: N-(3-methoxyphenyl)-6-methyl-1-phenethyl-pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: N-(3-methoxyphenyl)-6-methyl-1-phenethyl-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: N-(3-methoxyphenyl)-6-methyl-1-phenethylpyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: (3-methoxyphenyl)-(6-methyl-1-phenethyl-pyrazolo[3,4-d]pyrimidin-4-yl)amine Formula: C21H21N5O MolecularWeight: 359.42434

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=NN2CCC3=CC=CC=C3)C(=N1)NC4=CC(=CC=C4)OC

Isomeric SMILES

CC1=NC2=C(C=NN2CCC3=CC=CC=C3)C(=N1)NC4=CC(=CC=C4)OC

InChI

InChI=1S/C21H21N5O/c1-15-23-20(25-17-9-6-10-18(13-17)27-2)19-14-22-26(21(19)24-15)12-11-16-7-4-3-5-8-16/h3-10,13-14H,11-12H2,1-2H3,(H,23,24,25)