Product OPENEYE NAME: N-allyl-2-(4-fluorophenyl)sulfanyl-N-tetrahydropyran-2-yloxy-aniline
CAS Name: 2-[(4-fluorophenyl)thio]-N-(2-oxanyloxy)-N-prop-2-enylaniline
IUPAC NAME: 2-(4-fluorophenyl)sulfanyl-N-(oxan-2-yloxy)-N-prop-2-enylaniline
SYSTEMATIC NAME: 2-(4-fluorophenyl)sulfanyl-N-(oxan-2-yloxy)-N-prop-2-enyl-aniline
MOLECULAR FORMULA: C20H22FNO2S
MOLECULAR WEIGHT: 359.457583
SMILES: C=CCN(C1=CC=CC=C1SC2=CC=C(C=C2)F)OC3CCCCO3
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Product OPENEYE NAME: 6-amino-2-(2,5-dioxopyrrolidin-1-yl)-6-(2,5-dioxopyrrol-1-yl)hexanal
CAS Name: 6-amino-2-(2,5-dioxo-1-pyrrolidinyl)-6-(2,5-dioxo-1-pyrrolyl)hexanal
IUPAC NAME: 6-amino-2-(2,5-dioxopyrrolidin-1-yl)-6-(2,5-dioxopyrrol-1-yl)hexanal
SYSTEMATIC NAME: 6-azanyl-2-[2,5-bis(oxidanylidene)pyrrolidin-1-yl]-6-[2,5-bis(oxidanylidene)pyrrol-1-yl]hexanal
MOLECULAR FORMULA: C14H17N3O5
MOLECULAR WEIGHT: 307.30188
SMILES: C1CC(=O)N(C1=O)C(CCCC(N)N2C(=O)C=CC2=O)C=O
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Product OPENEYE NAME: (4,4,5,6,6-pentahydroxycyclohex-2-en-1-yl)-phenyl-methanone
CAS Name: (4,4,5,6,6-pentahydroxy-1-cyclohex-2-enyl)-phenylmethanone
IUPAC NAME: (4,4,5,6,6-pentahydroxycyclohex-2-en-1-yl)-phenylmethanone
SYSTEMATIC NAME: [4,4,5,6,6-pentakis(oxidanyl)cyclohex-2-en-1-yl]-phenyl-methanone
MOLECULAR FORMULA: C13H14O6
MOLECULAR WEIGHT: 266.24666
SMILES: C1=CC=C(C=C1)C(=O)C2C=CC(C(C2(O)O)O)(O)O
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Product OPENEYE NAME: 2-amino-2-(2-ethylsulfanylethylsulfamoyl)acetic acid
CAS Name: 2-amino-2-[2-(ethylthio)ethylsulfamoyl]acetic acid
IUPAC NAME: 2-amino-2-(2-ethylsulfanylethylsulfamoyl)acetic acid
SYSTEMATIC NAME: 2-azanyl-2-(2-ethylsulfanylethylsulfamoyl)ethanoic acid
MOLECULAR FORMULA: C6H14N2O4S2
MOLECULAR WEIGHT: 242.31636
SMILES: CCSCCNS(=O)(=O)C(C(=O)O)N
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Product OPENEYE NAME:
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IUPAC NAME:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C70H121N29O25
MOLECULAR WEIGHT: 1768.88904
SMILES: CC(C)CC(C(=O)O)NC(=O)C(CCCNC(=N)N)NC(=O)C(C(C)C)NC(=O)C(CCCNC(=N)N)NC(=O)C(C)NC(=O)CNC(=O)C(CCC(=O)N)NC(=O)C(CCC(=O)O)NC(=O)C(CCC(=O)N)NC(=O)C(CC(=O)N)NC(=O)C(CCCNC(=N)N)NC(=O)C(CCC(=O)O)NC(=O)CNC(=O)C(CCC(=O)N)NC(=O)C(CCC(=O)N)N
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Product OPENEYE NAME: 2-amino-2-(2-methoxyethylsulfamoyl)acetic acid
CAS Name: 2-amino-2-(2-methoxyethylsulfamoyl)acetic acid
IUPAC NAME: 2-amino-2-(2-methoxyethylsulfamoyl)acetic acid
SYSTEMATIC NAME: 2-azanyl-2-(2-methoxyethylsulfamoyl)ethanoic acid
MOLECULAR FORMULA: C5H12N2O5S
MOLECULAR WEIGHT: 212.22418
SMILES: COCCNS(=O)(=O)C(C(=O)O)N
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Product OPENEYE NAME: 1-[3-(4-chlorophenyl)-2-(4-fluorophenyl)cyclohexa-1,3-dien-1-yl]-4-nitro-benzene
CAS Name: 1-[3-(4-chlorophenyl)-2-(4-fluorophenyl)-1-cyclohexa-1,3-dienyl]-4-nitrobenzene
IUPAC NAME: 1-[3-(4-chlorophenyl)-2-(4-fluorophenyl)cyclohexa-1,3-dien-1-yl]-4-nitrobenzene
SYSTEMATIC NAME: 1-[3-(4-chlorophenyl)-2-(4-fluorophenyl)cyclohexa-1,3-dien-1-yl]-4-nitro-benzene
MOLECULAR FORMULA: C24H17ClFNO2
MOLECULAR WEIGHT: 405.848683
SMILES: C1CC(=C(C(=C1)C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)F)C4=CC=C(C=C4)[N+](=O)[O-]
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Product OPENEYE NAME: 2-ethyl-N'-phenyl-propanediamide
CAS Name: 2-ethyl-N'-phenylpropanediamide
IUPAC NAME: 2-ethyl-N'-phenylpropanediamide
SYSTEMATIC NAME: 2-ethyl-N'-phenyl-propanediamide
MOLECULAR FORMULA: C11H14N2O2
MOLECULAR WEIGHT: 206.24106
SMILES: CCC(C(=O)N)C(=O)NC1=CC=CC=C1
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Product OPENEYE NAME:
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MOLECULAR FORMULA: C66H113N27O26
MOLECULAR WEIGHT: 1700.76872
SMILES: CC(C)CC(C(=O)O)NC(=O)C(CCCNC(=N)N)NC(=O)C(C)NC(=O)C(CCCNC(=N)N)NC(=O)C(C)NC(=O)CNC(=O)C(CCCNC(=N)N)NC(=O)C(CCC(=O)O)NC(=O)C(CCC(=O)N)NC(=O)C(CC(=O)N)NC(=O)C(CO)NC(=O)C(CCC(=O)O)NC(=O)CNC(=O)C(CCC(=O)N)NC(=O)C(CCC(=O)O)N
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Product OPENEYE NAME: N-ethylbutan-1-amine; phenol
CAS Name: N-ethyl-1-butanamine; phenol
IUPAC NAME: N-ethylbutan-1-amine; phenol
SYSTEMATIC NAME: N-ethylbutan-1-amine; phenol
MOLECULAR FORMULA: C12H21NO
MOLECULAR WEIGHT: 195.30124
SMILES: CCCCNCC.C1=CC=C(C=C1)O
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Product OPENEYE NAME: ethyl 4-(3-fluoro-1-nitro-4-phenyl-cyclohexa-2,5-dien-1-yl)-3-oxo-pentanoate
CAS Name: 4-(3-fluoro-1-nitro-4-phenyl-1-cyclohexa-2,5-dienyl)-3-oxopentanoic acid ethyl ester
IUPAC NAME: ethyl 4-(3-fluoro-1-nitro-4-phenylcyclohexa-2,5-dien-1-yl)-3-oxopentanoate
SYSTEMATIC NAME: ethyl 4-(3-fluoranyl-1-nitro-4-phenyl-cyclohexa-2,5-dien-1-yl)-3-oxidanylidene-pentanoate
MOLECULAR FORMULA: C19H20FNO5
MOLECULAR WEIGHT: 361.364203
SMILES: CCOC(=O)CC(=O)C(C)C1(C=CC(C(=C1)F)C2=CC=CC=C2)[N+](=O)[O-]
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Product OPENEYE NAME: 4-[1-(1-carboxy-3-fluoro-4-phenyl-cyclohexa-2,5-dien-1-yl)ethyl]-2-(methylamino)thiazole-5-carboxylic acid
CAS Name: 4-[1-(1-carboxy-3-fluoro-4-phenyl-1-cyclohexa-2,5-dienyl)ethyl]-2-(methylamino)-5-thiazolecarboxylic acid
IUPAC NAME: 4-[1-(1-carboxy-3-fluoro-4-phenylcyclohexa-2,5-dien-1-yl)ethyl]-2-(methylamino)-1,3-thiazole-5-carboxylic acid
SYSTEMATIC NAME: 4-[1-(1-carboxy-3-fluoranyl-4-phenyl-cyclohexa-2,5-dien-1-yl)ethyl]-2-(methylamino)-1,3-thiazole-5-carboxylic acid
MOLECULAR FORMULA: C20H19FN2O4S
MOLECULAR WEIGHT: 402.439263
SMILES: CC(C1=C(SC(=N1)NC)C(=O)O)C2(C=CC(C(=C2)F)C3=CC=CC=C3)C(=O)O
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Product OPENEYE NAME: 2-(1,3-difluoro-4-phenyl-cyclohexa-2,5-dien-1-yl)propanoic acid
CAS Name: 2-(1,3-difluoro-4-phenyl-1-cyclohexa-2,5-dienyl)propanoic acid
IUPAC NAME: 2-(1,3-difluoro-4-phenylcyclohexa-2,5-dien-1-yl)propanoic acid
SYSTEMATIC NAME: 2-[1,3-bis(fluoranyl)-4-phenyl-cyclohexa-2,5-dien-1-yl]propanoic acid
MOLECULAR FORMULA: C15H14F2O2
MOLECULAR WEIGHT: 264.267266
SMILES: CC(C(=O)O)C1(C=CC(C(=C1)F)C2=CC=CC=C2)F
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Product OPENEYE NAME: ethyl 4-[1-(1-ethoxycarbonyl-3-fluoro-4-phenyl-cyclohexa-2,5-dien-1-yl)ethyl]-2-(methylamino)thiazole-5-carboxylate
CAS Name: 4-[1-(1-ethoxycarbonyl-3-fluoro-4-phenyl-1-cyclohexa-2,5-dienyl)ethyl]-2-(methylamino)-5-thiazolecarboxylic acid ethyl ester
IUPAC NAME: ethyl 4-[1-(1-ethoxycarbonyl-3-fluoro-4-phenylcyclohexa-2,5-dien-1-yl)ethyl]-2-(methylamino)-1,3-thiazole-5-carboxylate
SYSTEMATIC NAME: ethyl 4-[1-(1-ethoxycarbonyl-3-fluoranyl-4-phenyl-cyclohexa-2,5-dien-1-yl)ethyl]-2-(methylamino)-1,3-thiazole-5-carboxylate
MOLECULAR FORMULA: C24H27FN2O4S
MOLECULAR WEIGHT: 458.545583
SMILES: CCOC(=O)C1=C(N=C(S1)NC)C(C)C2(C=CC(C(=C2)F)C3=CC=CC=C3)C(=O)OCC
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Product OPENEYE NAME: ethyl 4-(3-fluoro-1-methoxy-4-phenyl-cyclohexa-2,5-dien-1-yl)-3-oxo-pentanoate
CAS Name: 4-(3-fluoro-1-methoxy-4-phenyl-1-cyclohexa-2,5-dienyl)-3-oxopentanoic acid ethyl ester
IUPAC NAME: ethyl 4-(3-fluoro-1-methoxy-4-phenylcyclohexa-2,5-dien-1-yl)-3-oxopentanoate
SYSTEMATIC NAME: ethyl 4-(3-fluoranyl-1-methoxy-4-phenyl-cyclohexa-2,5-dien-1-yl)-3-oxidanylidene-pentanoate
MOLECULAR FORMULA: C20H23FO4
MOLECULAR WEIGHT: 346.392623
SMILES: CCOC(=O)CC(=O)C(C)C1(C=CC(C(=C1)F)C2=CC=CC=C2)OC
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Product OPENEYE NAME: ethyl 4-[1-(1-acetyl-3-fluoro-4-phenyl-cyclohexa-2,5-dien-1-yl)ethyl]-2-(methylamino)thiazole-5-carboxylate
CAS Name: 4-[1-(1-acetyl-3-fluoro-4-phenyl-1-cyclohexa-2,5-dienyl)ethyl]-2-(methylamino)-5-thiazolecarboxylic acid ethyl ester
IUPAC NAME: ethyl 4-[1-(1-acetyl-3-fluoro-4-phenylcyclohexa-2,5-dien-1-yl)ethyl]-2-(methylamino)-1,3-thiazole-5-carboxylate
SYSTEMATIC NAME: ethyl 4-[1-(1-ethanoyl-3-fluoranyl-4-phenyl-cyclohexa-2,5-dien-1-yl)ethyl]-2-(methylamino)-1,3-thiazole-5-carboxylate
MOLECULAR FORMULA: C23H25FN2O3S
MOLECULAR WEIGHT: 428.519603
SMILES: CCOC(=O)C1=C(N=C(S1)NC)C(C)C2(C=CC(C(=C2)F)C3=CC=CC=C3)C(=O)C
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Product OPENEYE NAME: ethyl 4-[1-(3-fluoro-1-nitro-4-phenyl-cyclohexa-2,5-dien-1-yl)ethyl]-2-(methylamino)thiazole-5-carboxylate
CAS Name: 4-[1-(3-fluoro-1-nitro-4-phenyl-1-cyclohexa-2,5-dienyl)ethyl]-2-(methylamino)-5-thiazolecarboxylic acid ethyl ester
IUPAC NAME: ethyl 4-[1-(3-fluoro-1-nitro-4-phenylcyclohexa-2,5-dien-1-yl)ethyl]-2-(methylamino)-1,3-thiazole-5-carboxylate
SYSTEMATIC NAME: ethyl 4-[1-(3-fluoranyl-1-nitro-4-phenyl-cyclohexa-2,5-dien-1-yl)ethyl]-2-(methylamino)-1,3-thiazole-5-carboxylate
MOLECULAR FORMULA: C21H22FN3O4S
MOLECULAR WEIGHT: 431.480483
SMILES: CCOC(=O)C1=C(N=C(S1)NC)C(C)C2(C=CC(C(=C2)F)C3=CC=CC=C3)[N+](=O)[O-]
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Product OPENEYE NAME: 2-(3-fluoro-1-nitro-4-phenyl-cyclohexa-2,5-dien-1-yl)propanoic acid
CAS Name: 2-(3-fluoro-1-nitro-4-phenyl-1-cyclohexa-2,5-dienyl)propanoic acid
IUPAC NAME: 2-(3-fluoro-1-nitro-4-phenylcyclohexa-2,5-dien-1-yl)propanoic acid
SYSTEMATIC NAME: 2-(3-fluoranyl-1-nitro-4-phenyl-cyclohexa-2,5-dien-1-yl)propanoic acid
MOLECULAR FORMULA: C15H14FNO4
MOLECULAR WEIGHT: 291.274363
SMILES: CC(C(=O)O)C1(C=CC(C(=C1)F)C2=CC=CC=C2)[N+](=O)[O-]
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Product OPENEYE NAME: ethyl 4-[1-(3-fluoro-1-methoxy-4-phenyl-cyclohexa-2,5-dien-1-yl)ethyl]-2-(methylamino)thiazole-5-carboxylate
CAS Name: 4-[1-(3-fluoro-1-methoxy-4-phenyl-1-cyclohexa-2,5-dienyl)ethyl]-2-(methylamino)-5-thiazolecarboxylic acid ethyl ester
IUPAC NAME: ethyl 4-[1-(3-fluoro-1-methoxy-4-phenylcyclohexa-2,5-dien-1-yl)ethyl]-2-(methylamino)-1,3-thiazole-5-carboxylate
SYSTEMATIC NAME: ethyl 4-[1-(3-fluoranyl-1-methoxy-4-phenyl-cyclohexa-2,5-dien-1-yl)ethyl]-2-(methylamino)-1,3-thiazole-5-carboxylate
MOLECULAR FORMULA: C22H25FN2O3S
MOLECULAR WEIGHT: 416.508903
SMILES: CCOC(=O)C1=C(N=C(S1)NC)C(C)C2(C=CC(C(=C2)F)C3=CC=CC=C3)OC
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Product OPENEYE NAME: 4-[1-(3-fluoro-1-nitro-4-phenyl-cyclohexa-2,5-dien-1-yl)ethyl]-2-(methylamino)thiazole-5-carboxylic acid
CAS Name: 4-[1-(3-fluoro-1-nitro-4-phenyl-1-cyclohexa-2,5-dienyl)ethyl]-2-(methylamino)-5-thiazolecarboxylic acid
IUPAC NAME: 4-[1-(3-fluoro-1-nitro-4-phenylcyclohexa-2,5-dien-1-yl)ethyl]-2-(methylamino)-1,3-thiazole-5-carboxylic acid
SYSTEMATIC NAME: 4-[1-(3-fluoranyl-1-nitro-4-phenyl-cyclohexa-2,5-dien-1-yl)ethyl]-2-(methylamino)-1,3-thiazole-5-carboxylic acid
MOLECULAR FORMULA: C19H18FN3O4S
MOLECULAR WEIGHT: 403.427323
SMILES: CC(C1=C(SC(=N1)NC)C(=O)O)C2(C=CC(C(=C2)F)C3=CC=CC=C3)[N+](=O)[O-]
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Product OPENEYE NAME: 4-[1-(1-acetyl-3-fluoro-4-phenyl-cyclohexa-2,5-dien-1-yl)ethyl]-2-(methylamino)thiazole-5-carboxylic acid
CAS Name: 4-[1-(1-acetyl-3-fluoro-4-phenyl-1-cyclohexa-2,5-dienyl)ethyl]-2-(methylamino)-5-thiazolecarboxylic acid
IUPAC NAME: 4-[1-(1-acetyl-3-fluoro-4-phenylcyclohexa-2,5-dien-1-yl)ethyl]-2-(methylamino)-1,3-thiazole-5-carboxylic acid
SYSTEMATIC NAME: 4-[1-(1-ethanoyl-3-fluoranyl-4-phenyl-cyclohexa-2,5-dien-1-yl)ethyl]-2-(methylamino)-1,3-thiazole-5-carboxylic acid
MOLECULAR FORMULA: C21H21FN2O3S
MOLECULAR WEIGHT: 400.466443
SMILES: CC(C1=C(SC(=N1)NC)C(=O)O)C2(C=CC(C(=C2)F)C3=CC=CC=C3)C(=O)C
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