6-ethylsulfanyl-1-phenyl-5,6,7,7a-tetrahydro-2H-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 6-ethylsulfanyl-1-phenyl-5,6,7,7a-tetrahydro-2H-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 6-ethylsulfanyl-1-phenyl-5,6,7,7a-tetrahydro-2H-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 6-(ethylthio)-1-phenyl-5,6,7,7a-tetrahydro-2H-pyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 6-ethylsulfanyl-1-phenyl-5,6,7,7a-tetrahydro-2H-pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 6-(ethylthio)-1-phenyl-5,6,7,7a-tetrahydro-2H-pyrazolo[3,4-d]pyrimidin-4-one Formula: C13H16N4OS MolecularWeight: 276.35734

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1NC2C(=CNN2C3=CC=CC=C3)C(=O)N1

Isomeric SMILES

CCSC1NC2C(=CNN2C3=CC=CC=C3)C(=O)N1

InChI

InChI=1S/C13H16N4OS/c1-2-19-13-15-11-10(12(18)16-13)8-14-17(11)9-6-4-3-5-7-9/h3-8,11,13-15H,2H2,1H3,(H,16,18)