(6Z)-6-[(2-methylpropan-2-yl)oxy-oxidanyl-methylidene]-3-(4-phenylsulfanylphenyl)-1H-pyrazolo[1,5-a]pyrimidine-5,7-dione

Systemtic Name: (6Z)-6-[(2-methylpropan-2-yl)oxy-oxidanyl-methylidene]-3-(4-phenylsulfanylphenyl)-1H-pyrazolo[1,5-a]pyrimidine-5,7-dione Openeye Name: (6Z)-6-[tert-butoxy(hydroxy)methylene]-3-(4-phenylsulfanylphenyl)-1H-pyrazolo[1,5-a]pyrimidine-5,7-dione CAS Name: (6Z)-6-[hydroxy-[(2-methylpropan-2-yl)oxy]methylidene]-3-[4-(phenylthio)phenyl]-1H-pyrazolo[1,5-a]pyrimidine-5,7-dione IUPAC Name: (6Z)-6-[hydroxy-[(2-methylpropan-2-yl)oxy]methylidene]-3-(4-phenylsulfanylphenyl)-1H-pyrazolo[1,5-a]pyrimidine-5,7-dione Traditional Name: (6Z)-6-[tert-butoxy(hydroxy)methylene]-3-[4-(phenylthio)phenyl]-1H-pyrazolo[1,5-a]pyrimidine-5,7-quinone Formula: C23H21N3O4S MolecularWeight: 435.49554

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=C1C(=O)N=C2C(=CNN2C1=O)C3=CC=C(C=C3)SC4=CC=CC=C4)O

Isomeric SMILES

CC(C)(C)O/C(=C\1/C(=O)N=C2C(=CNN2C1=O)C3=CC=C(C=C3)SC4=CC=CC=C4)/O

InChI

InChI=1S/C23H21N3O4S/c1-23(2,3)30-22(29)18-20(27)25-19-17(13-24-26(19)21(18)28)14-9-11-16(12-10-14)31-15-7-5-4-6-8-15/h4-13,24,29H,1-3H3/b22-18-