Product OPENEYE NAME: 1-(4-fluoro-3-nitro-phenyl)-3-(3-fluorophenyl)urea
CAS Name: 1-(4-fluoro-3-nitrophenyl)-3-(3-fluorophenyl)urea
IUPAC NAME: 1-(4-fluoro-3-nitrophenyl)-3-(3-fluorophenyl)urea
SYSTEMATIC NAME: 1-(4-fluoranyl-3-nitro-phenyl)-3-(3-fluorophenyl)urea
MOLECULAR FORMULA: C13H9F2N3O3
MOLECULAR WEIGHT: 293.225666
SMILES: C1=CC(=CC(=C1)F)NC(=O)NC2=CC(=C(C=C2)F)[N+](=O)[O-]
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Product OPENEYE NAME: dimethyl 2-methylhexa-2,4-dienedioate
CAS Name: 2-methylhexa-2,4-dienedioic acid dimethyl ester
IUPAC NAME: dimethyl 2-methylhexa-2,4-dienedioate
SYSTEMATIC NAME: dimethyl 2-methylhexa-2,4-dienedioate
MOLECULAR FORMULA: C9H12O4
MOLECULAR WEIGHT: 184.18918
SMILES: CC(=CC=CC(=O)OC)C(=O)OC
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Product OPENEYE NAME: 2-(3-hydroxycyclohexyl)isoindoline-1,3-dione
CAS Name: 2-(3-hydroxycyclohexyl)isoindole-1,3-dione
IUPAC NAME: 2-(3-hydroxycyclohexyl)isoindole-1,3-dione
SYSTEMATIC NAME: 2-(3-oxidanylcyclohexyl)isoindole-1,3-dione
MOLECULAR FORMULA: C14H15NO3
MOLECULAR WEIGHT: 245.2738
SMILES: C1CC(CC(C1)O)N2C(=O)C3=CC=CC=C3C2=O
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Product OPENEYE NAME: 8-quinolyl N-dodecylcarbamate
CAS Name: N-dodecylcarbamic acid 8-quinolinyl ester
IUPAC NAME: quinolin-8-yl N-dodecylcarbamate
SYSTEMATIC NAME: quinolin-8-yl N-dodecylcarbamate
MOLECULAR FORMULA: C22H32N2O2
MOLECULAR WEIGHT: 356.50168
SMILES: CCCCCCCCCCCCNC(=O)OC1=CC=CC2=C1N=CC=C2
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Product OPENEYE NAME: 4-(4-bromophenyl)azo-N-isopropyl-N-methyl-aniline
CAS Name: 4-(4-bromophenyl)azo-N-methyl-N-propan-2-ylaniline
IUPAC NAME: 4-[(4-bromophenyl)diazenyl]-N-methyl-N-propan-2-ylaniline
SYSTEMATIC NAME: 4-[(4-bromophenyl)diazenyl]-N-methyl-N-propan-2-yl-aniline
MOLECULAR FORMULA: C16H18BrN3
MOLECULAR WEIGHT: 332.23822
SMILES: CC(C)N(C)C1=CC=C(C=C1)N=NC2=CC=C(C=C2)Br
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Product OPENEYE NAME: 2-(p-tolylsulfonylsulfanyl)acetic acid
CAS Name: 2-[(4-methylphenyl)sulfonylthio]acetic acid
IUPAC NAME: 2-(4-methylphenyl)sulfonylsulfanylacetic acid
SYSTEMATIC NAME: 2-(4-methylphenyl)sulfonylsulfanylethanoic acid
MOLECULAR FORMULA: C9H10O4S2
MOLECULAR WEIGHT: 246.3033
SMILES: CC1=CC=C(C=C1)S(=O)(=O)SCC(=O)O
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Product OPENEYE NAME: (4-nitrophenyl) (3-phenyloxiran-2-yl)methyl carbonate
CAS Name: carbonic acid (4-nitrophenyl) (3-phenyl-2-oxiranyl)methyl ester
IUPAC NAME: (4-nitrophenyl) (3-phenyloxiran-2-yl)methyl carbonate
SYSTEMATIC NAME: (4-nitrophenyl) (3-phenyloxiran-2-yl)methyl carbonate
MOLECULAR FORMULA: C16H13NO6
MOLECULAR WEIGHT: 315.27752
SMILES: C1=CC=C(C=C1)C2C(O2)COC(=O)OC3=CC=C(C=C3)[N+](=O)[O-]
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Product OPENEYE NAME: 4-[2,9-dimethyl-7-(4-sulfonatophenyl)-1,10-phenanthrolin-4-yl]benzenesulfonate
CAS Name: 4-[2,9-dimethyl-7-(4-sulfonatophenyl)-1,10-phenanthrolin-4-yl]benzenesulfonate
IUPAC NAME: 4-[2,9-dimethyl-7-(4-sulfonatophenyl)-1,10-phenanthrolin-4-yl]benzenesulfonate
SYSTEMATIC NAME: 4-[2,9-dimethyl-7-(4-sulfonatophenyl)-1,10-phenanthrolin-4-yl]benzenesulfonate
MOLECULAR FORMULA: C26H18N2O6S2-2
MOLECULAR WEIGHT: 518.56092
SMILES: CC1=NC2=C(C=CC3=C2N=C(C=C3C4=CC=C(C=C4)S(=O)(=O)[O-])C)C(=C1)C5=CC=C(C=C5)S(=O)(=O)[O-]
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Product OPENEYE NAME: tert-butyl 4-(1H-indol-3-ylmethyl)-2,5-dioxo-oxazolidine-3-carboxylate
CAS Name: 4-(1H-indol-3-ylmethyl)-2,5-dioxo-3-oxazolidinecarboxylic acid tert-butyl ester
IUPAC NAME: tert-butyl 4-(1H-indol-3-ylmethyl)-2,5-dioxo-1,3-oxazolidine-3-carboxylate
SYSTEMATIC NAME: tert-butyl 4-(1H-indol-3-ylmethyl)-2,5-bis(oxidanylidene)-1,3-oxazolidine-3-carboxylate
MOLECULAR FORMULA: C17H18N2O5
MOLECULAR WEIGHT: 330.33522
SMILES: CC(C)(C)OC(=O)N1C(C(=O)OC1=O)CC2=CNC3=CC=CC=C32
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Product OPENEYE NAME: 2-azanidylethylazanide; rhodium
CAS Name: 2-azanidylethylazanide; rhodium
IUPAC NAME: 2-azanidylethylazanide; rhodium
SYSTEMATIC NAME: 2-azanidylethylazanide; rhodium
MOLECULAR FORMULA: C6H18N6Rh-6
MOLECULAR WEIGHT: 277.15282
SMILES: C(C[NH-])[NH-].C(C[NH-])[NH-].C(C[NH-])[NH-].[Rh]
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Product OPENEYE NAME: diamino sulfite
CAS Name: sulfurous acid diamino ester
IUPAC NAME: diamino sulfite
SYSTEMATIC NAME: bis(azanyl) sulfite
MOLECULAR FORMULA: H4N2O3S
MOLECULAR WEIGHT: 112.10836
SMILES: NOS(=O)ON
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Product OPENEYE NAME: N-cyclopropyl-1H-1,2,4-triazole-5-carboxamide
CAS Name: N-cyclopropyl-1H-1,2,4-triazole-5-carboxamide
IUPAC NAME: N-cyclopropyl-1H-1,2,4-triazole-5-carboxamide
SYSTEMATIC NAME: N-cyclopropyl-1H-1,2,4-triazole-5-carboxamide
MOLECULAR FORMULA: C6H8N4O
MOLECULAR WEIGHT: 152.15392
SMILES: C1CC1NC(=O)C2=NC=NN2
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Product OPENEYE NAME: 2-chloro-N-[(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)methyl]acetamide
CAS Name: 2-chloro-N-[(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)methyl]acetamide
IUPAC NAME: 2-chloro-N-[(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)methyl]acetamide
SYSTEMATIC NAME: 2-chloranyl-N-[(5-methyl-3-oxidanylidene-2-phenyl-1H-pyrazol-4-yl)methyl]ethanamide
MOLECULAR FORMULA: C13H14ClN3O2
MOLECULAR WEIGHT: 279.72216
SMILES: CC1=C(C(=O)N(N1)C2=CC=CC=C2)CNC(=O)CCl
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Product OPENEYE NAME: 4-[(4-butoxy-3,5-diiodo-phenyl)methylene]-2-methyl-oxazol-5-one
CAS Name: 4-[(4-butoxy-3,5-diiodophenyl)methylidene]-2-methyl-5-oxazolone
IUPAC NAME: 4-[(4-butoxy-3,5-diiodophenyl)methylidene]-2-methyl-1,3-oxazol-5-one
SYSTEMATIC NAME: 4-[[4-butoxy-3,5-bis(iodanyl)phenyl]methylidene]-2-methyl-1,3-oxazol-5-one
MOLECULAR FORMULA: C15H15I2NO3
MOLECULAR WEIGHT: 511.09344
SMILES: CCCCOC1=C(C=C(C=C1I)C=C2C(=O)OC(=N2)C)I
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Product OPENEYE NAME: 4-[(3-chloro-4-nitro-phenyl)methylene]-2-methyl-oxazol-5-one
CAS Name: 4-[(3-chloro-4-nitrophenyl)methylidene]-2-methyl-5-oxazolone
IUPAC NAME: 4-[(3-chloro-4-nitrophenyl)methylidene]-2-methyl-1,3-oxazol-5-one
SYSTEMATIC NAME: 4-[(3-chloranyl-4-nitro-phenyl)methylidene]-2-methyl-1,3-oxazol-5-one
MOLECULAR FORMULA: C11H7ClN2O4
MOLECULAR WEIGHT: 266.63728
SMILES: CC1=NC(=CC2=CC(=C(C=C2)[N+](=O)[O-])Cl)C(=O)O1
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Product OPENEYE NAME: 1-(4-ethoxyphenyl)-3-[(4-phenyl-5-thioxo-1H-1,2,4-triazol-3-yl)methylamino]pyrrolidine-2,5-dione
CAS Name: 1-(4-ethoxyphenyl)-3-[(4-phenyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methylamino]pyrrolidine-2,5-dione
IUPAC NAME: 1-(4-ethoxyphenyl)-3-[(4-phenyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methylamino]pyrrolidine-2,5-dione
SYSTEMATIC NAME: 1-(4-ethoxyphenyl)-3-[(4-phenyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methylamino]pyrrolidine-2,5-dione
MOLECULAR FORMULA: C21H21N5O3S
MOLECULAR WEIGHT: 423.48814
SMILES: CCOC1=CC=C(C=C1)N2C(=O)CC(C2=O)NCC3=NNC(=S)N3C4=CC=CC=C4
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Product OPENEYE NAME: bis[2-(diisopropylamino)ethyl] 2,6-dimethylfuro[2,3-f]benzofuran-3,7-dicarboxylate
CAS Name: 2,6-dimethylfuro[2,3-f]benzofuran-3,7-dicarboxylic acid bis[2-[di(propan-2-yl)amino]ethyl] ester
IUPAC NAME: bis[2-[di(propan-2-yl)amino]ethyl] 2,6-dimethylfuro[2,3-f][1]benzofuran-3,7-dicarboxylate
SYSTEMATIC NAME: bis[2-[di(propan-2-yl)amino]ethyl] 2,6-dimethylfuro[2,3-f][1]benzofuran-3,7-dicarboxylate
MOLECULAR FORMULA: C30H44N2O6
MOLECULAR WEIGHT: 528.68016
SMILES: CC1=C(C2=CC3=C(C=C2O1)C(=C(O3)C)C(=O)OCCN(C(C)C)C(C)C)C(=O)OCCN(C(C)C)C(C)C
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Product OPENEYE NAME: 2-[1-(4-benzylphenyl)-3-[2-(2-fluorophenyl)ethyl]-5-oxo-2-thioxo-imidazolidin-4-yl]-N-(4-methoxyphenyl)acetamide
CAS Name: 2-[3-[2-(2-fluorophenyl)ethyl]-5-oxo-1-[4-(phenylmethyl)phenyl]-2-sulfanylidene-4-imidazolidinyl]-N-(4-methoxyphenyl)acetamide
IUPAC NAME: 2-[1-(4-benzylphenyl)-3-[2-(2-fluorophenyl)ethyl]-5-oxo-2-sulfanylideneimidazolidin-4-yl]-N-(4-methoxyphenyl)acetamide
SYSTEMATIC NAME: 2-[3-[2-(2-fluorophenyl)ethyl]-5-oxidanylidene-1-[4-(phenylmethyl)phenyl]-2-sulfanylidene-imidazolidin-4-yl]-N-(4-methoxyphenyl)ethanamide
MOLECULAR FORMULA: C33H30FN3O3S
MOLECULAR WEIGHT: 567.673003
SMILES: COC1=CC=C(C=C1)NC(=O)CC2C(=O)N(C(=S)N2CCC3=CC=CC=C3F)C4=CC=C(C=C4)CC5=CC=CC=C5
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Product OPENEYE NAME: N-(4-fluorophenyl)-2-[3-(2-morpholinoethyl)-5-oxo-1-phenyl-2-thioxo-imidazolidin-4-yl]acetamide
CAS Name: N-(4-fluorophenyl)-2-[3-[2-(4-morpholinyl)ethyl]-5-oxo-1-phenyl-2-sulfanylidene-4-imidazolidinyl]acetamide
IUPAC NAME: N-(4-fluorophenyl)-2-[3-(2-morpholin-4-ylethyl)-5-oxo-1-phenyl-2-sulfanylideneimidazolidin-4-yl]acetamide
SYSTEMATIC NAME: N-(4-fluorophenyl)-2-[3-(2-morpholin-4-ylethyl)-5-oxidanylidene-1-phenyl-2-sulfanylidene-imidazolidin-4-yl]ethanamide
MOLECULAR FORMULA: C23H25FN4O3S
MOLECULAR WEIGHT: 456.533003
SMILES: C1COCCN1CCN2C(C(=O)N(C2=S)C3=CC=CC=C3)CC(=O)NC4=CC=C(C=C4)F
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Product OPENEYE NAME: N-(4-ethoxyphenyl)-2-[1-(4-fluorophenyl)-5-oxo-2-thioxo-3-[[4-(trifluoromethoxy)phenyl]methyl]imidazolidin-4-yl]acetamide
CAS Name: N-(4-ethoxyphenyl)-2-[1-(4-fluorophenyl)-5-oxo-2-sulfanylidene-3-[[4-(trifluoromethoxy)phenyl]methyl]-4-imidazolidinyl]acetamide
IUPAC NAME: N-(4-ethoxyphenyl)-2-[1-(4-fluorophenyl)-5-oxo-2-sulfanylidene-3-[[4-(trifluoromethoxy)phenyl]methyl]imidazolidin-4-yl]acetamide
SYSTEMATIC NAME: N-(4-ethoxyphenyl)-2-[1-(4-fluorophenyl)-5-oxidanylidene-2-sulfanylidene-3-[[4-(trifluoromethyloxy)phenyl]methyl]imidazolidin-4-yl]ethanamide
MOLECULAR FORMULA: C27H23F4N3O4S
MOLECULAR WEIGHT: 561.547833
SMILES: CCOC1=CC=C(C=C1)NC(=O)CC2C(=O)N(C(=S)N2CC3=CC=C(C=C3)OC(F)(F)F)C4=CC=C(C=C4)F
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Product OPENEYE NAME: N-(2,4-dichlorophenyl)-2-(1-methyl-3-phenylsulfanyl-indol-2-yl)acetamide
CAS Name: N-(2,4-dichlorophenyl)-2-[1-methyl-3-(phenylthio)-2-indolyl]acetamide
IUPAC NAME: N-(2,4-dichlorophenyl)-2-(1-methyl-3-phenylsulfanylindol-2-yl)acetamide
SYSTEMATIC NAME: N-(2,4-dichlorophenyl)-2-(1-methyl-3-phenylsulfanyl-indol-2-yl)ethanamide
MOLECULAR FORMULA: C23H18Cl2N2OS
MOLECULAR WEIGHT: 441.37282
SMILES: CN1C2=CC=CC=C2C(=C1CC(=O)NC3=C(C=C(C=C3)Cl)Cl)SC4=CC=CC=C4
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Product OPENEYE NAME: N-(4-fluorophenyl)-3-(2-furylmethyl)-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide
CAS Name: N-(4-fluorophenyl)-3-(2-furanylmethyl)-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide
IUPAC NAME: N-(4-fluorophenyl)-3-(furan-2-ylmethyl)-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide
SYSTEMATIC NAME: N-(4-fluorophenyl)-3-(furan-2-ylmethyl)-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide
MOLECULAR FORMULA: C20H14FN3O3S
MOLECULAR WEIGHT: 395.406863
SMILES: C1=COC(=C1)CN2C(=O)C3=C(C=C(C=C3)C(=O)NC4=CC=C(C=C4)F)NC2=S
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