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

Systemtic Name: N-(3-methoxyphenyl)-1-methyl-6-methylsulfonyl-pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: N-(3-methoxyphenyl)-1-methyl-6-methylsulfonyl-pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: N-(3-methoxyphenyl)-1-methyl-6-methylsulfonyl-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: N-(3-methoxyphenyl)-1-methyl-6-methylsulfonylpyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: (6-mesyl-1-methyl-pyrazolo[3,4-d]pyrimidin-4-yl)-(3-methoxyphenyl)amine Formula: C14H15N5O3S MolecularWeight: 333.3656

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=NC(=N2)S(=O)(=O)C)NC3=CC(=CC=C3)OC

Isomeric SMILES

CN1C2=C(C=N1)C(=NC(=N2)S(=O)(=O)C)NC3=CC(=CC=C3)OC

InChI

InChI=1S/C14H15N5O3S/c1-19-13-11(8-15-19)12(17-14(18-13)23(3,20)21)16-9-5-4-6-10(7-9)22-2/h4-8H,1-3H3,(H,16,17,18)