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MOLECULAR FORMULA: C20H22N2O4
MOLECULAR WEIGHT: 354.39968
SMILES: CCOC(=O)N1[C@@H]([C@H]2[C@H]3[C@@H]([C@@H]1C=C2C)C(=O)N(C3=O)C4=CC=CC=C4)C
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MOLECULAR FORMULA: C26H26N2O4
MOLECULAR WEIGHT: 430.49564
SMILES: CCOC(=O)N1[C@@H]([C@@H]2C=C[C@]1([C@@H]3[C@H]2C(=O)N(C3=O)C4=CC=CC=C4)CC5=CC=CC=C5)C
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MOLECULAR FORMULA: C21H24N2O4
MOLECULAR WEIGHT: 368.42626
SMILES: CCOC(=O)N1[C@@H]([C@H]2[C@H]3[C@@H]([C@@]1(C=C2C)C)C(=O)N(C3=O)C4=CC=CC=C4)C
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MOLECULAR FORMULA: C21H24N2O4
MOLECULAR WEIGHT: 368.42626
SMILES: CCOC(=O)N1[C@@H]([C@]2([C@H]3[C@@H]([C@@H]1C=C2C)C(=O)N(C3=O)C4=CC=CC=C4)C)C
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MOLECULAR FORMULA: C21H24N2O4
MOLECULAR WEIGHT: 368.42626
SMILES: CCOC(=O)N1[C@@H]([C@H]2[C@H]3[C@@H]([C@@H]1C(=C2C)C)C(=O)N(C3=O)C4=CC=CC=C4)C
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MOLECULAR FORMULA: C23H26N2O4
MOLECULAR WEIGHT: 394.46354
SMILES: CCOC(=O)N1C(C2C=C3[C@@]1(CCCC3)C4C2C(=O)N(C4=O)C5=CC=CC=C5)C
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Product OPENEYE NAME: N-[(6-methoxy-2-pyridyl)carbamothioyl]benzamide
CAS Name: N-[[(6-methoxy-2-pyridinyl)amino]-sulfanylidenemethyl]benzamide
IUPAC NAME: N-[(6-methoxypyridin-2-yl)carbamothioyl]benzamide
SYSTEMATIC NAME: N-[(6-methoxypyridin-2-yl)carbamothioyl]benzamide
MOLECULAR FORMULA: C14H13N3O2S
MOLECULAR WEIGHT: 287.33692
SMILES: COC1=CC=CC(=N1)NC(=S)NC(=O)C2=CC=CC=C2
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Product OPENEYE NAME: 4-fluoropyrimidin-2-amine
CAS Name: 4-fluoro-2-pyrimidinamine
IUPAC NAME: 4-fluoropyrimidin-2-amine
SYSTEMATIC NAME: 4-fluoranylpyrimidin-2-amine
MOLECULAR FORMULA: C4H4FN3
MOLECULAR WEIGHT: 113.093063
SMILES: C1=CN=C(N=C1F)N
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Product OPENEYE NAME: 4-fluoro-N-propyl-pyrimidin-2-amine
CAS Name: 4-fluoro-N-propyl-2-pyrimidinamine
IUPAC NAME: 4-fluoro-N-propylpyrimidin-2-amine
SYSTEMATIC NAME: 4-fluoranyl-N-propyl-pyrimidin-2-amine
MOLECULAR FORMULA: C7H10FN3
MOLECULAR WEIGHT: 155.172803
SMILES: CCCNC1=NC=CC(=N1)F
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Product OPENEYE NAME: 4-fluoro-N-sec-butyl-pyrimidin-2-amine
CAS Name: N-butan-2-yl-4-fluoro-2-pyrimidinamine
IUPAC NAME: N-butan-2-yl-4-fluoropyrimidin-2-amine
SYSTEMATIC NAME: N-butan-2-yl-4-fluoranyl-pyrimidin-2-amine
MOLECULAR FORMULA: C8H12FN3
MOLECULAR WEIGHT: 169.199383
SMILES: CCC(C)NC1=NC=CC(=N1)F
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Product OPENEYE NAME: N',N'-diethyl-N-(4-fluoropyrimidin-2-yl)ethane-1,2-diamine
CAS Name: N',N'-diethyl-N-(4-fluoro-2-pyrimidinyl)ethane-1,2-diamine
IUPAC NAME: N',N'-diethyl-N-(4-fluoropyrimidin-2-yl)ethane-1,2-diamine
SYSTEMATIC NAME: N',N'-diethyl-N-(4-fluoranylpyrimidin-2-yl)ethane-1,2-diamine
MOLECULAR FORMULA: C10H17FN4
MOLECULAR WEIGHT: 212.267183
SMILES: CCN(CC)CCNC1=NC=CC(=N1)F
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Product OPENEYE NAME: 2-fluoro-N-sec-butyl-pyrimidin-4-amine
CAS Name: N-butan-2-yl-2-fluoro-4-pyrimidinamine
IUPAC NAME: N-butan-2-yl-2-fluoropyrimidin-4-amine
SYSTEMATIC NAME: N-butan-2-yl-2-fluoranyl-pyrimidin-4-amine
MOLECULAR FORMULA: C8H12FN3
MOLECULAR WEIGHT: 169.199383
SMILES: CCC(C)NC1=NC(=NC=C1)F
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Product OPENEYE NAME: N2,N4-dipropylpyrimidine-2,4-diamine
CAS Name: N2,N4-dipropylpyrimidine-2,4-diamine
IUPAC NAME: 2-N,4-N-dipropylpyrimidine-2,4-diamine
SYSTEMATIC NAME: N2,N4-dipropylpyrimidine-2,4-diamine
MOLECULAR FORMULA: C10H18N4
MOLECULAR WEIGHT: 194.27672
SMILES: CCCNC1=NC(=NC=C1)NCCC
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Product OPENEYE NAME: 2-fluoro-1H-pyrimidin-6-one
CAS Name: 2-fluoro-1H-pyrimidin-6-one
IUPAC NAME: 2-fluoro-1H-pyrimidin-6-one
SYSTEMATIC NAME: 2-fluoranyl-1H-pyrimidin-6-one
MOLECULAR FORMULA: C4H3FN2O
MOLECULAR WEIGHT: 114.077823
SMILES: C1=CN=C(NC1=O)F
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Product OPENEYE NAME: 2-fluoro-4-methoxy-pyrimidine
CAS Name: 2-fluoro-4-methoxypyrimidine
IUPAC NAME: 2-fluoro-4-methoxypyrimidine
SYSTEMATIC NAME: 2-fluoranyl-4-methoxy-pyrimidine
MOLECULAR FORMULA: C5H5FN2O
MOLECULAR WEIGHT: 128.104403
SMILES: COC1=NC(=NC=C1)F
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Product OPENEYE NAME: 4-fluoro-2-methoxy-pyrimidine
CAS Name: 4-fluoro-2-methoxypyrimidine
IUPAC NAME: 4-fluoro-2-methoxypyrimidine
SYSTEMATIC NAME: 4-fluoranyl-2-methoxy-pyrimidine
MOLECULAR FORMULA: C5H5FN2O
MOLECULAR WEIGHT: 128.104403
SMILES: COC1=NC=CC(=N1)F
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MOLECULAR FORMULA: C19H14F5N5O4
MOLECULAR WEIGHT: 471.337576
SMILES: CN1C2=C(C(C3=C(N2)N(C(=O)N(C3=O)C)C)C4=C(C(=C(C(=C4F)F)F)F)F)C(=O)N(C1=O)C
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Product OPENEYE NAME: 5-[amino(methyl)amino]-6-chloro-2-methyl-pyridazin-3-one
CAS Name: 5-[amino(methyl)amino]-6-chloro-2-methyl-3-pyridazinone
IUPAC NAME: 5-[amino(methyl)amino]-6-chloro-2-methylpyridazin-3-one
SYSTEMATIC NAME: 5-[azanyl(methyl)amino]-6-chloranyl-2-methyl-pyridazin-3-one
MOLECULAR FORMULA: C6H9ClN4O
MOLECULAR WEIGHT: 188.61486
SMILES: CN1C(=O)C=C(C(=N1)Cl)N(C)N
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Product OPENEYE NAME: 1-ethyl-2-methylsulfanyl-6-oxo-4-phenyl-pyrimidine-5-carbonitrile
CAS Name: 1-ethyl-2-(methylthio)-6-oxo-4-phenyl-5-pyrimidinecarbonitrile
IUPAC NAME: 1-ethyl-2-methylsulfanyl-6-oxo-4-phenylpyrimidine-5-carbonitrile
SYSTEMATIC NAME: 1-ethyl-2-methylsulfanyl-6-oxidanylidene-4-phenyl-pyrimidine-5-carbonitrile
MOLECULAR FORMULA: C14H13N3OS
MOLECULAR WEIGHT: 271.33752
SMILES: CCN1C(=O)C(=C(N=C1SC)C2=CC=CC=C2)C#N
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MOLECULAR FORMULA: C15H14N3O+
MOLECULAR WEIGHT: 252.29116
SMILES: CN1C=C([N+]2=C1C3=C(C4=CC=CC=C4CC3)N=C2)O
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MOLECULAR FORMULA: C16H16N3O+
MOLECULAR WEIGHT: 266.31774
SMILES: CC1=C([N+]2=C(N1C)C3=C(C4=CC=CC=C4CC3)N=C2)O
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MOLECULAR FORMULA: C17H15N3O2
MOLECULAR WEIGHT: 293.3199
SMILES: CC(=O)C1=C([N+]2=C(N1C)C3=C(C4=CC=CC=C4CC3)N=C2)[O-]
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MOLECULAR FORMULA: C17H16N3O2+
MOLECULAR WEIGHT: 294.32784
SMILES: CC(=O)C1=C([N+]2=C(N1C)C3=C(C4=CC=CC=C4CC3)N=C2)O
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