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Pyrimidones
Description:
Compounds that contain a pyrimidine ring, which bears a ketone. Pyrimidine is a 6-membered ring consisting of four carbon atoms and two nitrogen centers at the 1- and 3- ring positions.
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5-(propan-2-yl)-1,2,3,4-tetrahydropyrimidine-2,4-dioneIUPAC Name: 5-propan-2-yl-1H-pyrimidine-2,4-dioneSMILES: CC(C)C1=CNC(=O)NC1=OInChIKey: NWNKIJNFNJCAHN-UHFFFAOYSA-NInChI: InChI=1S/C7H10N2O2/c1-4(2)5-3-8-7(11)9-6(5)10/h3-4H,1-2H3,(H2,8,9,10,11) -
3-(4-fluorophenyl)-1H-pyrimidine-2,4-dioneCas Number: 1204297-90-4 Compound CID: 45496265Formula: C10H7FN2O2 Molecular Weight: 206.17SMILES: C1=CC(=CC=C1N2C(=O)C=CNC2=O)FInChIKey: BMFGMMFYIDDQBZ-UHFFFAOYSA-NInChI: InChI=1S/C10H7FN2O2/c11-7-1-3-8(4-2-7)13-9(14)5-6-12-10(13)15/h1-6H,(H,12,15) -
2-methoxy-4-methyl-1H-pyrimidin-6-oneCas Number: 55996-28-6 Compound CID: 135437273Formula: C6H8N2O2 Molecular Weight: 140.14IUPAC Name: 2-methoxy-4-methyl-1H-pyrimidin-6-oneSMILES: CC1=CC(=O)NC(=N1)OCInChIKey: CRYUGFDHGVCIJW-UHFFFAOYSA-NInChI: InChI=1S/C6H8N2O2/c1-4-3-5(9)8-6(7-4)10-2/h3H,1-2H3,(H,7,8,9) -
1-(4-bromo-3-fluoro-phenyl)hexahydropyrimidine-2,4-dioneCas Number: 1515197-90-6 Compound CID: 79777001IUPAC Name: 1-(4-bromo-3-fluorophenyl)-1,3-diazinane-2,4-dioneSMILES: C1CN(C(=O)NC1=O)C2=CC(=C(C=C2)Br)FInChIKey: CMDVHROFZVQEBL-UHFFFAOYSA-NInChI: InChI=1S/C10H8BrFN2O2/c11-7-2-1-6(5-8(7)12)14-4-3-9(15)13-10(14)16/h1-2,5H,3-4H2,(H,13,15,16) -
1-cyclohexyl-N-methylpropan-2-amine;5-ethyl-5-phenyl-1,3-diazinane-2,4,6-trioneFormula: C22H33N3O3 Molecular Weight: 387.5IUPAC Name: 1-cyclohexyl-N-methylpropan-2-amine;5-ethyl-5-phenyl-1,3-diazinane-2,4,6-trioneSMILES: CCC1(C(=O)NC(=O)NC1=O)C2=CC=CC=C2.CC(CC1CCCCC1)NCInChIKey: MJCBWPMBFCUHBP-UHFFFAOYSA-NInChI: show more Synonyms: CHEMBL3833301
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Tezacitabine monohydrateCas Number: 171176-43-5Formula: C10H14FN3O5 Molecular Weight: 275.23IUPAC Name: 4-amino-1-[(2R,3E,4S,5R)-3-(fluoromethylidene)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one;hydrateSMILES: C1=CN(C(=O)N=C1N)C2C(=CF)C(C(O2)CO)O.OInChIKey: XPYQFIISZQCINN-QVXDJYSKSA-NInChI: InChI=1S/C10H12FN3O4.H2O/c11-3-5-8(16)6(4-15)18-9(5)14-2-1-7(12)13-10(14)17;/h1-3,6,8-9,15-16H,4H2,(H2,12,13,17);1H2/b5-3+;/t6-,8+,9-;/m1./s1Synonyms: Tezacitabine monohydrate | Tezacitabine [USAN:INN] | Mdl 101,731 | Q27291019 | Tezacitabine [USAN] | CHEMBL3989496 | ...
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ProxibarbalCas Number: 2537-29-3Formula: C10H14N2O4 Molecular Weight: 226.23IUPAC Name: 5-(2-hydroxypropyl)-5-prop-2-enyl-1,3-diazinane-2,4,6-trioneSMILES: CC(CC1(C(=O)NC(=O)NC1=O)CC=C)OInChIKey: VNLMRPAWAMPLNZ-UHFFFAOYSA-NInChI: InChI=1S/C10H14N2O4/c1-3-4-10(5-6(2)13)7(14)11-9(16)12-8(10)15/h3,6,13H,1,4-5H2,2H3,(H2,11,12,14,15,16)Synonyms: Proxibarbal | 5-Allilo-5-(beta-hydroksypropylo)-barbiturowy | Ipronal, (+-)- | 2,4,6(1H,3H,5H)-PYRIMIDINETRIONE, 5-(2...
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5-ethenyl-1,2,3,4-tetrahydropyrimidine-2,4-dioneCas Number: 37107-81-6 Compound CID: 99305Formula: C6H6N2O2 Molecular Weight: 138.12IUPAC Name: 5-ethenyl-1H-pyrimidine-2,4-dioneSMILES: C=CC1C(=O)NC(=O)NC=1InChIKey: ZRYZBEQILKESAW-UHFFFAOYSA-NInChI: InChI=1S/C6H6N2O2/c1-2-4-3-7-6(10)8-5(4)9/h2-3H,1H2,(H2,7,8,9,10)
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3-(4-chlorophenyl)-1,6-dimethylpyrimido[5,4-e][1,2,4]triazine-5,7(1H,6H)-dioneCas Number: 42285-61-0Formula: C13H10ClN5O2 Molecular Weight: 303.7IUPAC Name: 3-(4-chlorophenyl)-1,6-dimethylpyrimido[5,4-e][1,2,4]triazine-5,7-dioneSMILES: CN1C2=NC(=O)N(C(=O)C2=NC(=N1)C3=CC=C(C=C3)Cl)CInChIKey: UCEGDYDPOSBUTP-UHFFFAOYSA-NInChI: InChI=1S/C13H10ClN5O2/c1-18-12(20)9-11(16-13(18)21)19(2)17-10(15-9)7-3-5-8(14)6-4-7/h3-6H,1-2H3Synonyms: MLS000523518 | SMR000122591 | 3-(4-Chloro-phenyl)-1,6-dimethyl-1H-pyrimido[5,4-e][1,2,4]triazine-5,7-dione | 3-(4-chl...
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1,6-Dimethyl-3-(2-pyridinyl)pyrimido[5,4-e][1,2,4]triazine-5,7-dioneFormula: C12H10N6O2 Molecular Weight: 270.25IUPAC Name: 1,6-dimethyl-3-pyridin-2-ylpyrimido[5,4-e][1,2,4]triazine-5,7-dioneSMILES: CN1C2=NC(=O)N(C(=O)C2=NC(=N1)C3=CC=CC=N3)CInChIKey: HDXJYJIPXWVRSM-UHFFFAOYSA-NInChI: InChI=1S/C12H10N6O2/c1-17-11(19)8-10(15-12(17)20)18(2)16-9(14-8)7-5-3-4-6-13-7/h3-6H,1-2H3Synonyms: MLS000684008 | SMR000291658 | 1,6-dimethyl-3-(2-pyridinyl)pyrimido[5,4-e][1,2,4]triazine-5,7-dione | 1,6-dimethyl-3-p...
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5-Furfurylidene-2-Thiobarbituric AcidCas Number: 27430-18-8 Compound CID: 676561Formula: C9H6N2O3S Molecular Weight: 222.22IUPAC Name: 5-(furan-2-ylmethylidene)-2-sulfanylidene-1,3-diazinane-4,6-dioneSMILES: C1=COC(=C1)C=C2C(=O)NC(=S)NC2=OInChIKey: VQRARDATQWRHGF-UHFFFAOYSA-NInChI: InChI=1S/C9H6N2O3S/c12-7-6(4-5-2-1-3-14-5)8(13)11-9(15)10-7/h1-4H,(H2,10,11,12,13,15)Synonyms: 5-Furfurylidene-2-Thiobarbituric Acid | NSC-96626 | 5-(furan-2-ylmethylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione...
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2-Amino-4,6-(1H,5H)-pyrimidinedioneCas Number: 4425-67-6 Compound CID: 78146Formula: C4H5N3O2 Molecular Weight: 127.10IUPAC Name: 2-amino-1H-pyrimidine-4,6-dioneSMILES: C1C(=O)NC(=NC1=O)NInChIKey: BTYNVOQLMBUUMS-UHFFFAOYSA-NInChI: InChI=1S/C4H5N3O2/c5-4-6-2(8)1-3(9)7-4/h1H2,(H3,5,6,7,8,9)
