N,N-diethyl-2-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-2-phenyl-ethanamide

Systemtic Name: N,N-diethyl-2-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-2-phenyl-ethanamide Openeye Name: N,N-diethyl-2-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-2-phenyl-acetamide CAS Name: N,N-diethyl-2-[(1-methyl-4-pyrazolo[3,4-d]pyrimidinyl)thio]-2-phenylacetamide IUPAC Name: N,N-diethyl-2-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-2-phenylacetamide Traditional Name: N,N-diethyl-2-[(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)thio]-2-phenyl-acetamide Formula: C18H21N5OS MolecularWeight: 355.45724

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C(C1=CC=CC=C1)SC2=NC=NC3=C2C=NN3C

Isomeric SMILES

CCN(CC)C(=O)C(C1=CC=CC=C1)SC2=NC=NC3=C2C=NN3C

InChI

InChI=1S/C18H21N5OS/c1-4-23(5-2)18(24)15(13-9-7-6-8-10-13)25-17-14-11-21-22(3)16(14)19-12-20-17/h6-12,15H,4-5H2,1-3H3