2,6-diethyl-5-(phenylmethylsulfanyl)pyrazolo[4,3-d]pyrimidin-7-one

Systemtic Name: 2,6-diethyl-5-(phenylmethylsulfanyl)pyrazolo[4,3-d]pyrimidin-7-one Openeye Name: 5-benzylsulfanyl-2,6-diethyl-pyrazolo[4,3-d]pyrimidin-7-one CAS Name: 2,6-diethyl-5-(phenylmethylthio)-7-pyrazolo[4,3-d]pyrimidinone IUPAC Name: 5-benzylsulfanyl-2,6-diethylpyrazolo[4,3-d]pyrimidin-7-one Traditional Name: 5-(benzylthio)-2,6-diethyl-pyrazolo[4,3-d]pyrimidin-7-one Formula: C16H18N4OS MolecularWeight: 314.40532

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C2C(=N1)C(=O)N(C(=N2)SCC3=CC=CC=C3)CC

Isomeric SMILES

CCN1C=C2C(=N1)C(=O)N(C(=N2)SCC3=CC=CC=C3)CC

InChI

InChI=1S/C16H18N4OS/c1-3-19-10-13-14(18-19)15(21)20(4-2)16(17-13)22-11-12-8-6-5-7-9-12/h5-10H,3-4,11H2,1-2H3