2-[4-azanyl-5-(3-methoxyphenyl)-3-methyl-pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl-N,N-dipropyl-butanamide

Systemtic Name: 2-[4-azanyl-5-(3-methoxyphenyl)-3-methyl-pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl-N,N-dipropyl-butanamide Openeye Name: 2-[4-amino-5-(3-methoxyphenyl)-3-methyl-pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl-N,N-dipropyl-butanamide CAS Name: 2-[[4-amino-5-(3-methoxyphenyl)-3-methyl-6-pyrazolo[3,4-d]pyrimidinyl]thio]-N,N-dipropylbutanamide IUPAC Name: 2-[4-amino-5-(3-methoxyphenyl)-3-methylpyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl-N,N-dipropylbutanamide Traditional Name: 2-[[4-amino-5-(3-methoxyphenyl)-3-methyl-pyrazolo[3,4-d]pyrimidin-6-yl]thio]-N,N-dipropyl-butyramide Formula: C23H32N6O2S MolecularWeight: 456.60418

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)C(=O)C(CC)SC1=NC2=NN=C(C2=C(N1C3=CC(=CC=C3)OC)N)C

Isomeric SMILES

CCCN(CCC)C(=O)C(CC)SC1=NC2=NN=C(C2=C(N1C3=CC(=CC=C3)OC)N)C

InChI

InChI=1S/C23H32N6O2S/c1-6-12-28(13-7-2)22(30)18(8-3)32-23-25-21-19(15(4)26-27-21)20(24)29(23)16-10-9-11-17(14-16)31-5/h9-11,14,18H,6-8,12-13,24H2,1-5H3