Product OPENEYE NAME: 1-(2-fluoro-1-octoxy-4-phenyl-cyclohexa-2,5-dien-1-yl)ethanol
CAS Name: 1-(2-fluoro-1-octoxy-4-phenyl-1-cyclohexa-2,5-dienyl)ethanol
IUPAC NAME: 1-(2-fluoro-1-octoxy-4-phenylcyclohexa-2,5-dien-1-yl)ethanol
SYSTEMATIC NAME: 1-(2-fluoranyl-1-octoxy-4-phenyl-cyclohexa-2,5-dien-1-yl)ethanol
MOLECULAR FORMULA: C22H31FO2
MOLECULAR WEIGHT: 346.478743
SMILES: CCCCCCCCOC1(C=CC(C=C1F)C2=CC=CC=C2)C(C)O
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Product OPENEYE NAME: 5-benzyl-1,2,4-trimethyl-imidazole
CAS Name: 1,2,4-trimethyl-5-(phenylmethyl)imidazole
IUPAC NAME: 5-benzyl-1,2,4-trimethylimidazole
SYSTEMATIC NAME: 1,2,4-trimethyl-5-(phenylmethyl)imidazole
MOLECULAR FORMULA: C13H16N2
MOLECULAR WEIGHT: 200.27954
SMILES: CC1=C(N(C(=N1)C)C)CC2=CC=CC=C2
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Product OPENEYE NAME: 3-ethyl-1-methyl-phenanthrene-4-sulfinate
CAS Name: 3-ethyl-1-methyl-4-phenanthrenesulfinate
IUPAC NAME: 3-ethyl-1-methylphenanthrene-4-sulfinate
SYSTEMATIC NAME: 3-ethyl-1-methyl-phenanthrene-4-sulfinate
MOLECULAR FORMULA: C17H15O2S-
MOLECULAR WEIGHT: 283.3648
SMILES: CCC1=C(C2=C(C=CC3=CC=CC=C32)C(=C1)C)S(=O)[O-]
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Product OPENEYE NAME: 3-ethyl-1-methyl-phenanthrene-4-sulfinic acid
CAS Name: 3-ethyl-1-methyl-4-phenanthrenesulfinic acid
IUPAC NAME: 3-ethyl-1-methylphenanthrene-4-sulfinic acid
SYSTEMATIC NAME: 3-ethyl-1-methyl-phenanthrene-4-sulfinic acid
MOLECULAR FORMULA: C17H16O2S
MOLECULAR WEIGHT: 284.37274
SMILES: CCC1=C(C2=C(C=CC3=CC=CC=C32)C(=C1)C)S(=O)O
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Product OPENEYE NAME: (4,6-diamino-1,3,5-triazin-2-yl)-triethyl-ammonium
CAS Name: (4,6-diamino-1,3,5-triazin-2-yl)-triethylammonium
IUPAC NAME: (4,6-diamino-1,3,5-triazin-2-yl)-triethylazanium
SYSTEMATIC NAME: [4,6-bis(azanyl)-1,3,5-triazin-2-yl]-triethyl-azanium
MOLECULAR FORMULA: C9H19N6+
MOLECULAR WEIGHT: 211.28736
SMILES: CC[N+](CC)(CC)C1=NC(=NC(=N1)N)N
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Product OPENEYE NAME: ethanol; 1-propyl-3-thioxanthen-9-ylidene-2-(trifluoromethyl)piperazine
CAS Name: ethanol; 1-propyl-3-(9-thioxanthenylidene)-2-(trifluoromethyl)piperazine
IUPAC NAME: ethanol; 1-propyl-3-thioxanthen-9-ylidene-2-(trifluoromethyl)piperazine
SYSTEMATIC NAME: ethanol; 1-propyl-3-thioxanthen-9-ylidene-2-(trifluoromethyl)piperazine
MOLECULAR FORMULA: C23H27F3N2OS
MOLECULAR WEIGHT: 436.53349
SMILES: CCCN1CCNC(=C2C3=CC=CC=C3SC4=CC=CC=C42)C1C(F)(F)F.CCO
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Product OPENEYE NAME: 1-propyl-3-thioxanthen-9-ylidene-2-(trifluoromethyl)piperazine
CAS Name: 1-propyl-3-(9-thioxanthenylidene)-2-(trifluoromethyl)piperazine
IUPAC NAME: 1-propyl-3-thioxanthen-9-ylidene-2-(trifluoromethyl)piperazine
SYSTEMATIC NAME: 1-propyl-3-thioxanthen-9-ylidene-2-(trifluoromethyl)piperazine
MOLECULAR FORMULA: C21H21F3N2S
MOLECULAR WEIGHT: 390.46505
SMILES: CCCN1CCNC(=C2C3=CC=CC=C3SC4=CC=CC=C42)C1C(F)(F)F
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Product OPENEYE NAME: 2-piperazin-1-ylpentan-2-ol
CAS Name: 2-(1-piperazinyl)-2-pentanol
IUPAC NAME: 2-piperazin-1-ylpentan-2-ol
SYSTEMATIC NAME: 2-piperazin-1-ylpentan-2-ol
MOLECULAR FORMULA: C9H20N2O
MOLECULAR WEIGHT: 172.2679
SMILES: CCCC(C)(N1CCNCC1)O
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Product OPENEYE NAME: 1-[(3Z)-3-(2-chlorothioxanthen-9-ylidene)-2-propyl-piperazin-1-yl]ethanol
CAS Name: 1-[(3Z)-3-(2-chloro-9-thioxanthenylidene)-2-propyl-1-piperazinyl]ethanol
IUPAC NAME: 1-[(3Z)-3-(2-chlorothioxanthen-9-ylidene)-2-propylpiperazin-1-yl]ethanol
SYSTEMATIC NAME: 1-[(3Z)-3-(2-chloranylthioxanthen-9-ylidene)-2-propyl-piperazin-1-yl]ethanol
MOLECULAR FORMULA: C22H25ClN2OS
MOLECULAR WEIGHT: 400.9647
SMILES: CCCC1/C(=C/2\C3=CC=CC=C3SC4=C2C=C(C=C4)Cl)/NCCN1C(C)O
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Product OPENEYE NAME: 1,1,1-trifluoro-2-phenothiazin-10-yl-3-piperazin-1-yl-hexan-3-ol
CAS Name: 1,1,1-trifluoro-2-(10-phenothiazinyl)-3-(1-piperazinyl)-3-hexanol
IUPAC NAME: 1,1,1-trifluoro-2-phenothiazin-10-yl-3-piperazin-1-ylhexan-3-ol
SYSTEMATIC NAME: 1,1,1-tris(fluoranyl)-2-phenothiazin-10-yl-3-piperazin-1-yl-hexan-3-ol
MOLECULAR FORMULA: C22H26F3N3OS
MOLECULAR WEIGHT: 437.52155
SMILES: CCCC(C(C(F)(F)F)N1C2=CC=CC=C2SC3=CC=CC=C31)(N4CCNCC4)O
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Product OPENEYE NAME: ethanol; 1-propylpiperazine
CAS Name: ethanol; 1-propylpiperazine
IUPAC NAME: ethanol; 1-propylpiperazine
SYSTEMATIC NAME: ethanol; 1-propylpiperazine
MOLECULAR FORMULA: C9H22N2O
MOLECULAR WEIGHT: 174.28378
SMILES: CCCN1CCNCC1.CCO
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Product OPENEYE NAME: 1-chloro-1-phenothiazin-10-yl-2-piperazin-1-yl-pentan-2-ol
CAS Name: 1-chloro-1-(10-phenothiazinyl)-2-(1-piperazinyl)-2-pentanol
IUPAC NAME: 1-chloro-1-phenothiazin-10-yl-2-piperazin-1-ylpentan-2-ol
SYSTEMATIC NAME: 1-chloranyl-1-phenothiazin-10-yl-2-piperazin-1-yl-pentan-2-ol
MOLECULAR FORMULA: C21H26ClN3OS
MOLECULAR WEIGHT: 403.96864
SMILES: CCCC(C(N1C2=CC=CC=C2SC3=CC=CC=C31)Cl)(N4CCNCC4)O
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Product OPENEYE NAME: (9E)-9-propylidene-2-(trifluoromethyl)thioxanthene
CAS Name: (9E)-9-propylidene-2-(trifluoromethyl)thioxanthene
IUPAC NAME: (9E)-9-propylidene-2-(trifluoromethyl)thioxanthene
SYSTEMATIC NAME: (9E)-9-propylidene-2-(trifluoromethyl)thioxanthene
MOLECULAR FORMULA: C17H13F3S
MOLECULAR WEIGHT: 306.34533
SMILES: CC/C=C/1\C2=CC=CC=C2SC3=C1C=C(C=C3)C(F)(F)F
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Product OPENEYE NAME: 4-nitrobenzamide hydrochloride
CAS Name: 4-nitrobenzamide hydrochloride
IUPAC NAME: 4-nitrobenzamide hydrochloride
SYSTEMATIC NAME: 4-nitrobenzamide hydrochloride
MOLECULAR FORMULA: C7H7ClN2O3
MOLECULAR WEIGHT: 202.59508
SMILES: C1=CC(=CC=C1C(=O)N)[N+](=O)[O-].Cl
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Product OPENEYE NAME: 4-nitro-2-sulfamoyl-benzamide
CAS Name: 4-nitro-2-sulfamoylbenzamide
IUPAC NAME: 4-nitro-2-sulfamoylbenzamide
SYSTEMATIC NAME: 4-nitro-2-sulfamoyl-benzamide
MOLECULAR FORMULA: C7H7N3O5S
MOLECULAR WEIGHT: 245.21258
SMILES: C1=CC(=C(C=C1[N+](=O)[O-])S(=O)(=O)N)C(=O)N
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Product OPENEYE NAME: (4-amino-3-propanoyl-phenyl)methanesulfonic acid
CAS Name: [4-amino-3-(1-oxopropyl)phenyl]methanesulfonic acid
IUPAC NAME: (4-amino-3-propanoylphenyl)methanesulfonic acid
SYSTEMATIC NAME: (4-azanyl-3-propanoyl-phenyl)methanesulfonic acid
MOLECULAR FORMULA: C10H13NO4S
MOLECULAR WEIGHT: 243.27952
SMILES: CCC(=O)C1=C(C=CC(=C1)CS(=O)(=O)O)N
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Product OPENEYE NAME: (4-aminophenoxy)arsonic acid
CAS Name: (4-aminophenoxy)arsonic acid
IUPAC NAME: (4-aminophenoxy)arsonic acid
SYSTEMATIC NAME: (4-azanylphenoxy)arsonic acid
MOLECULAR FORMULA: C6H8AsNO4
MOLECULAR WEIGHT: 233.05362
SMILES: C1=CC(=CC=C1N)O[As](=O)(O)O
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Product OPENEYE NAME: 1-[2-(2,4-dichlorophenyl)ethyl]imidazole
CAS Name: 1-[2-(2,4-dichlorophenyl)ethyl]imidazole
IUPAC NAME: 1-[2-(2,4-dichlorophenyl)ethyl]imidazole
SYSTEMATIC NAME: 1-[2-(2,4-dichlorophenyl)ethyl]imidazole
MOLECULAR FORMULA: C11H10Cl2N2
MOLECULAR WEIGHT: 241.1165
SMILES: C1=CC(=C(C=C1Cl)Cl)CCN2C=CN=C2
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Product OPENEYE NAME: (Z)-2-(3H-inden-1-yl)-3-(4-methylsulfinylphenyl)prop-2-enoic acid
CAS Name: (Z)-2-(3H-inden-1-yl)-3-(4-methylsulfinylphenyl)-2-propenoic acid
IUPAC NAME: (Z)-2-(3H-inden-1-yl)-3-(4-methylsulfinylphenyl)prop-2-enoic acid
SYSTEMATIC NAME: (Z)-2-(3H-inden-1-yl)-3-(4-methylsulfinylphenyl)prop-2-enoic acid
MOLECULAR FORMULA: C19H16O3S
MOLECULAR WEIGHT: 324.39354
SMILES: CS(=O)C1=CC=C(C=C1)/C=C(/C2=CCC3=CC=CC=C32)\C(=O)O
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Product OPENEYE NAME: 2-(2,5,5a,6-tetrahydro-1H-chromeno[2,3-b]pyridin-7-yl)acetic acid
CAS Name: 2-(2,5,5a,6-tetrahydro-1H-[1]benzopyrano[2,3-b]pyridin-7-yl)acetic acid
IUPAC NAME: 2-(2,5,5a,6-tetrahydro-1H-chromeno[2,3-b]pyridin-7-yl)acetic acid
SYSTEMATIC NAME: 2-(2,5,5a,6-tetrahydro-1H-chromeno[2,3-b]pyridin-7-yl)ethanoic acid
MOLECULAR FORMULA: C14H15NO3
MOLECULAR WEIGHT: 245.2738
SMILES: C1C=CC2=C(N1)OC3=CC=C(CC3C2)CC(=O)O
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Product OPENEYE NAME: 1-[1-(2,4-dichlorophenyl)ethyl]imidazole
CAS Name: 1-[1-(2,4-dichlorophenyl)ethyl]imidazole
IUPAC NAME: 1-[1-(2,4-dichlorophenyl)ethyl]imidazole
SYSTEMATIC NAME: 1-[1-(2,4-dichlorophenyl)ethyl]imidazole
MOLECULAR FORMULA: C11H10Cl2N2
MOLECULAR WEIGHT: 241.1165
SMILES: CC(C1=C(C=C(C=C1)Cl)Cl)N2C=CN=C2
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Product OPENEYE NAME: 1-[5-(2-chloroethoxymethyl)-4-hydroxy-tetrahydrofuran-2-yl]pyrimidine-2,4-dione
CAS Name: 1-[5-(2-chloroethoxymethyl)-4-hydroxy-2-oxolanyl]pyrimidine-2,4-dione
IUPAC NAME: 1-[5-(2-chloroethoxymethyl)-4-hydroxyoxolan-2-yl]pyrimidine-2,4-dione
SYSTEMATIC NAME: 1-[5-(2-chloroethyloxymethyl)-4-oxidanyl-oxolan-2-yl]pyrimidine-2,4-dione
MOLECULAR FORMULA: C11H15ClN2O5
MOLECULAR WEIGHT: 290.7002
SMILES: C1C(C(OC1N2C=CC(=O)NC2=O)COCCCl)O
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