2-[[1-(4-chlorophenyl)-4-oxidanylidene-2H-pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl]-N-prop-2-enyl-ethanamide

Systemtic Name: 2-[[1-(4-chlorophenyl)-4-oxidanylidene-2H-pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl]-N-prop-2-enyl-ethanamide Openeye Name: N-allyl-2-[[1-(4-chlorophenyl)-4-oxo-2H-pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl]acetamide CAS Name: 2-[[1-(4-chlorophenyl)-4-oxo-2H-pyrazolo[3,4-d]pyrimidin-6-yl]thio]-N-prop-2-enylacetamide IUPAC Name: 2-[[1-(4-chlorophenyl)-4-oxo-2H-pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl]-N-prop-2-enylacetamide Traditional Name: N-allyl-2-[[1-(4-chlorophenyl)-4-keto-2H-pyrazolo[3,4-d]pyrimidin-6-yl]thio]acetamide Formula: C16H14ClN5O2S MolecularWeight: 375.83266

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)CSC1=NC(=O)C2=CNN(C2=N1)C3=CC=C(C=C3)Cl

Isomeric SMILES

C=CCNC(=O)CSC1=NC(=O)C2=CNN(C2=N1)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H14ClN5O2S/c1-2-7-18-13(23)9-25-16-20-14-12(15(24)21-16)8-19-22(14)11-5-3-10(17)4-6-11/h2-6,8,19H,1,7,9H2,(H,18,23)