2-[4-azanyl-3-methyl-5-(3-methylphenyl)pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl-N-ethyl-N-(phenylmethyl)ethanamide

Systemtic Name: 2-[4-azanyl-3-methyl-5-(3-methylphenyl)pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl-N-ethyl-N-(phenylmethyl)ethanamide Openeye Name: 2-[4-amino-3-methyl-5-(m-tolyl)pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl-N-benzyl-N-ethyl-acetamide CAS Name: 2-[[4-amino-3-methyl-5-(3-methylphenyl)-6-pyrazolo[3,4-d]pyrimidinyl]thio]-N-ethyl-N-(phenylmethyl)acetamide IUPAC Name: 2-[4-amino-3-methyl-5-(3-methylphenyl)pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl-N-benzyl-N-ethylacetamide Traditional Name: 2-[[4-amino-3-methyl-5-(m-tolyl)pyrazolo[3,4-d]pyrimidin-6-yl]thio]-N-benzyl-N-ethyl-acetamide Formula: C24H26N6OS MolecularWeight: 446.56784

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=CC=C1)C(=O)CSC2=NC3=NN=C(C3=C(N2C4=CC=CC(=C4)C)N)C

Isomeric SMILES

CCN(CC1=CC=CC=C1)C(=O)CSC2=NC3=NN=C(C3=C(N2C4=CC=CC(=C4)C)N)C

InChI

InChI=1S/C24H26N6OS/c1-4-29(14-18-10-6-5-7-11-18)20(31)15-32-24-26-23-21(17(3)27-28-23)22(25)30(24)19-12-8-9-16(2)13-19/h5-13H,4,14-15,25H2,1-3H3