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

Systemtic Name: 2-[4-azanyl-5-(2-chlorophenyl)-3-methyl-pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl-N,N-dipropyl-ethanamide Openeye Name: 2-[4-amino-5-(2-chlorophenyl)-3-methyl-pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl-N,N-dipropyl-acetamide CAS Name: 2-[[4-amino-5-(2-chlorophenyl)-3-methyl-6-pyrazolo[3,4-d]pyrimidinyl]thio]-N,N-dipropylacetamide IUPAC Name: 2-[4-amino-5-(2-chlorophenyl)-3-methylpyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl-N,N-dipropylacetamide Traditional Name: 2-[[4-amino-5-(2-chlorophenyl)-3-methyl-pyrazolo[3,4-d]pyrimidin-6-yl]thio]-N,N-dipropyl-acetamide Formula: C20H25ClN6OS MolecularWeight: 432.9701

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)C(=O)CSC1=NC2=NN=C(C2=C(N1C3=CC=CC=C3Cl)N)C

Isomeric SMILES

CCCN(CCC)C(=O)CSC1=NC2=NN=C(C2=C(N1C3=CC=CC=C3Cl)N)C

InChI

InChI=1S/C20H25ClN6OS/c1-4-10-26(11-5-2)16(28)12-29-20-23-19-17(13(3)24-25-19)18(22)27(20)15-9-7-6-8-14(15)21/h6-9H,4-5,10-12,22H2,1-3H3