4-methyl-1-phenethyl-3-prop-2-enylsulfanyl-pyrazolo[4,3-d]pyrimidine-5,7-dione

Systemtic Name: 4-methyl-1-phenethyl-3-prop-2-enylsulfanyl-pyrazolo[4,3-d]pyrimidine-5,7-dione Openeye Name: 3-allylsulfanyl-4-methyl-1-phenethyl-pyrazolo[4,3-d]pyrimidine-5,7-dione CAS Name: 4-methyl-1-phenethyl-3-(prop-2-enylthio)pyrazolo[4,3-d]pyrimidine-5,7-dione IUPAC Name: 4-methyl-1-phenethyl-3-prop-2-enylsulfanylpyrazolo[4,3-d]pyrimidine-5,7-dione Traditional Name: 3-(allylthio)-4-methyl-1-phenethyl-pyrazolo[4,3-d]pyrimidine-5,7-quinone Formula: C17H18N4O2S MolecularWeight: 342.41542

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)NC1=O)N(N=C2SCC=C)CCC3=CC=CC=C3

Isomeric SMILES

CN1C2=C(C(=O)NC1=O)N(N=C2SCC=C)CCC3=CC=CC=C3

InChI

InChI=1S/C17H18N4O2S/c1-3-11-24-16-14-13(15(22)18-17(23)20(14)2)21(19-16)10-9-12-7-5-4-6-8-12/h3-8H,1,9-11H2,2H3,(H,18,22,23)