Product OPENEYE NAME: tert-butyl N-[[3-[2-carbamoyl-5-fluoro-3-(2-fluoro-4-iodo-anilino)phenoxy]phenyl]methyl]carbamate
CAS Name: N-[[3-[2-carbamoyl-5-fluoro-3-(2-fluoro-4-iodoanilino)phenoxy]phenyl]methyl]carbamic acid tert-butyl ester
IUPAC NAME: tert-butyl N-[[3-[2-carbamoyl-5-fluoro-3-(2-fluoro-4-iodoanilino)phenoxy]phenyl]methyl]carbamate
SYSTEMATIC NAME: tert-butyl N-[[3-[2-aminocarbonyl-5-fluoranyl-3-[(2-fluoranyl-4-iodanyl-phenyl)amino]phenoxy]phenyl]methyl]carbamate
MOLECULAR FORMULA: C25H24F2IN3O4
MOLECULAR WEIGHT: 595.377036
SMILES: CC(C)(C)OC(=O)NCC1=CC(=CC=C1)OC2=C(C(=CC(=C2)F)NC3=C(C=C(C=C3)I)F)C(=O)N
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Product OPENEYE NAME: 3-[[6-[2-(3-methyl-4-phenyl-phenyl)ethoxy]tetralin-1-yl]amino]cyclobutanecarboxylic acid
CAS Name: 3-[[6-[2-(3-methyl-4-phenylphenyl)ethoxy]-1,2,3,4-tetrahydronaphthalen-1-yl]amino]-1-cyclobutanecarboxylic acid
IUPAC NAME: 3-[[6-[2-(3-methyl-4-phenylphenyl)ethoxy]-1,2,3,4-tetrahydronaphthalen-1-yl]amino]cyclobutane-1-carboxylic acid
SYSTEMATIC NAME: 3-[[6-[2-(3-methyl-4-phenyl-phenyl)ethoxy]-1,2,3,4-tetrahydronaphthalen-1-yl]amino]cyclobutane-1-carboxylic acid
MOLECULAR FORMULA: C30H33NO3
MOLECULAR WEIGHT: 455.58792
SMILES: CC1=C(C=CC(=C1)CCOC2=CC3=C(C=C2)C(CCC3)NC4CC(C4)C(=O)O)C5=CC=CC=C5
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Product OPENEYE NAME: 3-[methyl-[6-[5-(3-methyl-4-phenyl-phenyl)-1,2,4-oxadiazol-3-yl]tetralin-1-yl]amino]cyclobutanecarboxylic acid
CAS Name: 3-[methyl-[6-[5-(3-methyl-4-phenylphenyl)-1,2,4-oxadiazol-3-yl]-1,2,3,4-tetrahydronaphthalen-1-yl]amino]-1-cyclobutanecarboxylic acid
IUPAC NAME: 3-[methyl-[6-[5-(3-methyl-4-phenylphenyl)-1,2,4-oxadiazol-3-yl]-1,2,3,4-tetrahydronaphthalen-1-yl]amino]cyclobutane-1-carboxylic acid
SYSTEMATIC NAME: 3-[methyl-[6-[5-(3-methyl-4-phenyl-phenyl)-1,2,4-oxadiazol-3-yl]-1,2,3,4-tetrahydronaphthalen-1-yl]amino]cyclobutane-1-carboxylic acid
MOLECULAR FORMULA: C31H31N3O3
MOLECULAR WEIGHT: 493.59614
SMILES: CC1=C(C=CC(=C1)C2=NC(=NO2)C3=CC4=C(C=C3)C(CCC4)N(C)C5CC(C5)C(=O)O)C6=CC=CC=C6
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Product OPENEYE NAME: 3-[[6-[5-[4-(3-furyl)-3-methyl-phenyl]-1,2,4-oxadiazol-3-yl]tetralin-1-yl]amino]cyclobutanecarboxylic acid
CAS Name: 3-[[6-[5-[4-(3-furanyl)-3-methylphenyl]-1,2,4-oxadiazol-3-yl]-1,2,3,4-tetrahydronaphthalen-1-yl]amino]-1-cyclobutanecarboxylic acid
IUPAC NAME: 3-[[6-[5-[4-(furan-3-yl)-3-methylphenyl]-1,2,4-oxadiazol-3-yl]-1,2,3,4-tetrahydronaphthalen-1-yl]amino]cyclobutane-1-carboxylic acid
SYSTEMATIC NAME: 3-[[6-[5-[4-(furan-3-yl)-3-methyl-phenyl]-1,2,4-oxadiazol-3-yl]-1,2,3,4-tetrahydronaphthalen-1-yl]amino]cyclobutane-1-carboxylic acid
MOLECULAR FORMULA: C28H27N3O4
MOLECULAR WEIGHT: 469.53168
SMILES: CC1=C(C=CC(=C1)C2=NC(=NO2)C3=CC4=C(C=C3)C(CCC4)NC5CC(C5)C(=O)O)C6=COC=C6
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Product OPENEYE NAME: 3-[[6-[5-[3,5-dimethyl-4-(4-pyridyl)phenyl]-1,2,4-oxadiazol-3-yl]tetralin-1-yl]amino]cyclobutanecarboxylic acid
CAS Name: 3-[[6-[5-(3,5-dimethyl-4-pyridin-4-ylphenyl)-1,2,4-oxadiazol-3-yl]-1,2,3,4-tetrahydronaphthalen-1-yl]amino]-1-cyclobutanecarboxylic acid
IUPAC NAME: 3-[[6-[5-(3,5-dimethyl-4-pyridin-4-ylphenyl)-1,2,4-oxadiazol-3-yl]-1,2,3,4-tetrahydronaphthalen-1-yl]amino]cyclobutane-1-carboxylic acid
SYSTEMATIC NAME: 3-[[6-[5-(3,5-dimethyl-4-pyridin-4-yl-phenyl)-1,2,4-oxadiazol-3-yl]-1,2,3,4-tetrahydronaphthalen-1-yl]amino]cyclobutane-1-carboxylic acid
MOLECULAR FORMULA: C30H30N4O3
MOLECULAR WEIGHT: 494.5842
SMILES: CC1=CC(=CC(=C1C2=CC=NC=C2)C)C3=NC(=NO3)C4=CC5=C(C=C4)C(CCC5)NC6CC(C6)C(=O)O
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Product OPENEYE NAME: 3-[[6-[5-(3,5-dimethyl-4-phenyl-phenyl)-1,2,4-oxadiazol-3-yl]tetralin-1-yl]amino]cyclobutanecarboxylic acid
CAS Name: 3-[[6-[5-(3,5-dimethyl-4-phenylphenyl)-1,2,4-oxadiazol-3-yl]-1,2,3,4-tetrahydronaphthalen-1-yl]amino]-1-cyclobutanecarboxylic acid
IUPAC NAME: 3-[[6-[5-(3,5-dimethyl-4-phenylphenyl)-1,2,4-oxadiazol-3-yl]-1,2,3,4-tetrahydronaphthalen-1-yl]amino]cyclobutane-1-carboxylic acid
SYSTEMATIC NAME: 3-[[6-[5-(3,5-dimethyl-4-phenyl-phenyl)-1,2,4-oxadiazol-3-yl]-1,2,3,4-tetrahydronaphthalen-1-yl]amino]cyclobutane-1-carboxylic acid
MOLECULAR FORMULA: C31H31N3O3
MOLECULAR WEIGHT: 493.59614
SMILES: CC1=CC(=CC(=C1C2=CC=CC=C2)C)C3=NC(=NO3)C4=CC5=C(C=C4)C(CCC5)NC6CC(C6)C(=O)O
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Product OPENEYE NAME: N-[(6-methylsulfonyl-2,3-dihydro-1,4-benzodioxin-3-yl)methyl]butan-1-amine
CAS Name: N-[(6-methylsulfonyl-2,3-dihydro-1,4-benzodioxin-3-yl)methyl]-1-butanamine
IUPAC NAME: N-[(6-methylsulfonyl-2,3-dihydro-1,4-benzodioxin-3-yl)methyl]butan-1-amine
SYSTEMATIC NAME: N-[(6-methylsulfonyl-2,3-dihydro-1,4-benzodioxin-3-yl)methyl]butan-1-amine
MOLECULAR FORMULA: C14H21NO4S
MOLECULAR WEIGHT: 299.38584
SMILES: CCCCNCC1COC2=C(O1)C=C(C=C2)S(=O)(=O)C
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Product OPENEYE NAME: 4-[(6-methylsulfonyl-2,3-dihydro-1,4-benzodioxin-3-yl)methyl]morpholine
CAS Name: 4-[(6-methylsulfonyl-2,3-dihydro-1,4-benzodioxin-3-yl)methyl]morpholine
IUPAC NAME: 4-[(6-methylsulfonyl-2,3-dihydro-1,4-benzodioxin-3-yl)methyl]morpholine
SYSTEMATIC NAME: 4-[(6-methylsulfonyl-2,3-dihydro-1,4-benzodioxin-3-yl)methyl]morpholine
MOLECULAR FORMULA: C14H19NO5S
MOLECULAR WEIGHT: 313.36936
SMILES: CS(=O)(=O)C1=CC2=C(C=C1)OCC(O2)CN3CCOCC3
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Product OPENEYE NAME: N-ethyl-N-[(6-methylsulfonyl-2,3-dihydro-1,4-benzodioxin-3-yl)methyl]propan-1-amine
CAS Name: N-ethyl-N-[(6-methylsulfonyl-2,3-dihydro-1,4-benzodioxin-3-yl)methyl]-1-propanamine
IUPAC NAME: N-ethyl-N-[(6-methylsulfonyl-2,3-dihydro-1,4-benzodioxin-3-yl)methyl]propan-1-amine
SYSTEMATIC NAME: N-ethyl-N-[(6-methylsulfonyl-2,3-dihydro-1,4-benzodioxin-3-yl)methyl]propan-1-amine
MOLECULAR FORMULA: C15H23NO4S
MOLECULAR WEIGHT: 313.41242
SMILES: CCCN(CC)CC1COC2=C(O1)C=C(C=C2)S(=O)(=O)C
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Product OPENEYE NAME: N-[(6-methylsulfonyl-2,3-dihydro-1,4-benzodioxin-3-yl)methyl]propan-2-amine
CAS Name: N-[(6-methylsulfonyl-2,3-dihydro-1,4-benzodioxin-3-yl)methyl]-2-propanamine
IUPAC NAME: N-[(6-methylsulfonyl-2,3-dihydro-1,4-benzodioxin-3-yl)methyl]propan-2-amine
SYSTEMATIC NAME: N-[(6-methylsulfonyl-2,3-dihydro-1,4-benzodioxin-3-yl)methyl]propan-2-amine
MOLECULAR FORMULA: C13H19NO4S
MOLECULAR WEIGHT: 285.35926
SMILES: CC(C)NCC1COC2=C(O1)C=C(C=C2)S(=O)(=O)C
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Product OPENEYE NAME: 2-methyl-N-[(6-methylsulfonyl-2,3-dihydro-1,4-benzodioxin-3-yl)methyl]propan-1-amine
CAS Name: 2-methyl-N-[(6-methylsulfonyl-2,3-dihydro-1,4-benzodioxin-3-yl)methyl]-1-propanamine
IUPAC NAME: 2-methyl-N-[(6-methylsulfonyl-2,3-dihydro-1,4-benzodioxin-3-yl)methyl]propan-1-amine
SYSTEMATIC NAME: 2-methyl-N-[(6-methylsulfonyl-2,3-dihydro-1,4-benzodioxin-3-yl)methyl]propan-1-amine
MOLECULAR FORMULA: C14H21NO4S
MOLECULAR WEIGHT: 299.38584
SMILES: CC(C)CNCC1COC2=C(O1)C=C(C=C2)S(=O)(=O)C
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Product OPENEYE NAME: N-[(5-fluoro-7-methylsulfonyl-2,3-dihydro-1,4-benzodioxin-2-yl)methyl]prop-2-en-1-amine
CAS Name: N-[(5-fluoro-7-methylsulfonyl-2,3-dihydro-1,4-benzodioxin-2-yl)methyl]-2-propen-1-amine
IUPAC NAME: N-[(5-fluoro-7-methylsulfonyl-2,3-dihydro-1,4-benzodioxin-2-yl)methyl]prop-2-en-1-amine
SYSTEMATIC NAME: N-[(5-fluoranyl-7-methylsulfonyl-2,3-dihydro-1,4-benzodioxin-2-yl)methyl]prop-2-en-1-amine
MOLECULAR FORMULA: C13H16FNO4S
MOLECULAR WEIGHT: 301.333843
SMILES: CS(=O)(=O)C1=CC(=C2C(=C1)OC(CO2)CNCC=C)F
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Product OPENEYE NAME: N-[[(3S)-5-fluoro-6-methylsulfonyl-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]ethanamine
CAS Name: N-[[(3S)-5-fluoro-6-methylsulfonyl-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]ethanamine
IUPAC NAME: N-[[(3S)-5-fluoro-6-methylsulfonyl-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]ethanamine
SYSTEMATIC NAME: N-[[(3S)-5-fluoranyl-6-methylsulfonyl-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]ethanamine
MOLECULAR FORMULA: C12H16FNO4S
MOLECULAR WEIGHT: 289.323143
SMILES: CCNC[C@H]1COC2=C(O1)C(=C(C=C2)S(=O)(=O)C)F
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Product OPENEYE NAME: 1-[(2S)-5-fluoro-7-methylsulfonyl-2,3-dihydro-1,4-benzodioxin-2-yl]-N-methyl-methanamine
CAS Name: 1-[(2S)-5-fluoro-7-methylsulfonyl-2,3-dihydro-1,4-benzodioxin-2-yl]-N-methylmethanamine
IUPAC NAME: 1-[(2S)-5-fluoro-7-methylsulfonyl-2,3-dihydro-1,4-benzodioxin-2-yl]-N-methylmethanamine
SYSTEMATIC NAME: 1-[(2S)-5-fluoranyl-7-methylsulfonyl-2,3-dihydro-1,4-benzodioxin-2-yl]-N-methyl-methanamine
MOLECULAR FORMULA: C11H14FNO4S
MOLECULAR WEIGHT: 275.296563
SMILES: CNC[C@H]1COC2=C(C=C(C=C2O1)S(=O)(=O)C)F
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Product OPENEYE NAME: N-[[(3S)-6-(trifluoromethylsulfonyl)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]propan-1-amine
CAS Name: N-[[(3S)-6-(trifluoromethylsulfonyl)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-1-propanamine
IUPAC NAME: N-[[(3S)-6-(trifluoromethylsulfonyl)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]propan-1-amine
SYSTEMATIC NAME: N-[[(3S)-6-(trifluoromethylsulfonyl)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]propan-1-amine
MOLECULAR FORMULA: C13H16F3NO4S
MOLECULAR WEIGHT: 339.33065
SMILES: CCCNC[C@H]1COC2=C(O1)C=C(C=C2)S(=O)(=O)C(F)(F)F
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Product OPENEYE NAME: 1-[2-[2-[2,2-bis[2-[2-[2-[bis[(2-phenyl-1,3-dioxolan-4-yl)methyl]amino]propoxy]propoxy]propoxymethyl]butoxy]-1-methyl-ethoxy]-1-methyl-ethoxy]-N,N-bis[(2-phenyl-1,3-dioxolan-4-yl)methyl]propan-2-amine
CAS Name: 1-[1-[1-[2,2-bis[2-[2-[2-[bis[(2-phenyl-1,3-dioxolan-4-yl)methyl]amino]propoxy]propoxy]propoxymethyl]butoxy]propan-2-yloxy]propan-2-yloxy]-N,N-bis[(2-phenyl-1,3-dioxolan-4-yl)methyl]-2-propanamine
IUPAC NAME: 1-[1-[1-[2,2-bis[2-[2-[2-[bis[(2-phenyl-1,3-dioxolan-4-yl)methyl]amino]propoxy]propoxy]propoxymethyl]butoxy]propan-2-yloxy]propan-2-yloxy]-N,N-bis[(2-phenyl-1,3-dioxolan-4-yl)methyl]propan-2-amine
SYSTEMATIC NAME: 1-[1-[1-[2,2-bis[2-[2-[2-[bis[(2-phenyl-1,3-dioxolan-4-yl)methyl]amino]propoxy]propoxy]propoxymethyl]butoxy]propan-2-yloxy]propan-2-yloxy]-N,N-bis[(2-phenyl-1,3-dioxolan-4-yl)methyl]propan-2-amine
MOLECULAR FORMULA: C93H131N3O21
MOLECULAR WEIGHT: 1627.04274
SMILES: CCC(COCC(C)OCC(C)OCC(C)N(CC1COC(O1)C2=CC=CC=C2)CC3COC(O3)C4=CC=CC=C4)(COCC(C)OCC(C)OCC(C)N(CC5COC(O5)C6=CC=CC=C6)CC7COC(O7)C8=CC=CC=C8)COCC(C)OCC(C)OCC(C)N(CC9COC(O9)C1=CC=CC=C1)CC1COC(O1)C1=CC=CC=C1
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Product OPENEYE NAME: 1-[2-[2-[2-[2-[2-(2-hydroxypropoxy)propoxy]butoxymethyl]-2-[2-[2-(2-hydroxypropoxy)propoxy]propoxymethyl]butoxy]-1-methyl-ethoxy]-1-methyl-ethoxy]propan-2-ol
CAS Name: 1-[1-[1-[2-[2-[2-(2-hydroxypropoxy)propoxy]butoxymethyl]-2-[2-[2-(2-hydroxypropoxy)propoxy]propoxymethyl]butoxy]propan-2-yloxy]propan-2-yloxy]-2-propanol
IUPAC NAME: 1-[1-[1-[2-[2-[2-(2-hydroxypropoxy)propoxy]butoxymethyl]-2-[2-[2-(2-hydroxypropoxy)propoxy]propoxymethyl]butoxy]propan-2-yloxy]propan-2-yloxy]propan-2-ol
SYSTEMATIC NAME: 1-[1-[1-[2-[2-[2-(2-oxidanylpropoxy)propoxy]butoxymethyl]-2-[2-[2-(2-oxidanylpropoxy)propoxy]propoxymethyl]butoxy]propan-2-yloxy]propan-2-yloxy]propan-2-ol
MOLECULAR FORMULA: C34H70O12
MOLECULAR WEIGHT: 670.9124
SMILES: CCC(COCC(CC)(COCC(C)OCC(C)OCC(C)O)COCC(C)OCC(C)OCC(C)O)OCC(C)OCC(C)O
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Product OPENEYE NAME: 3-[2-[2-[2-[2-[2-[2-[2-(2-cyanopropoxy)propoxy]propoxy]butoxymethyl]-2-[2-[2-[2-(2-cyanopropoxy)propoxy]propoxy]propoxymethyl]butoxy]-1-methyl-ethoxy]-1-methyl-ethoxy]-1-methyl-ethoxy]-2-methyl-propanenitrile
CAS Name: 3-[1-[1-[1-[2-[2-[2-[2-(2-cyanopropoxy)propoxy]propoxy]butoxymethyl]-2-[2-[2-[2-(2-cyanopropoxy)propoxy]propoxy]propoxymethyl]butoxy]propan-2-yloxy]propan-2-yloxy]propan-2-yloxy]-2-methylpropanenitrile
IUPAC NAME: 3-[1-[1-[1-[2-[2-[2-[2-(2-cyanopropoxy)propoxy]propoxy]butoxymethyl]-2-[2-[2-[2-(2-cyanopropoxy)propoxy]propoxy]propoxymethyl]butoxy]propan-2-yloxy]propan-2-yloxy]propan-2-yloxy]-2-methylpropanenitrile
SYSTEMATIC NAME: 3-[1-[1-[1-[2-[2-[2-[2-(2-cyanopropoxy)propoxy]propoxy]butoxymethyl]-2-[2-[2-[2-(2-cyanopropoxy)propoxy]propoxy]propoxymethyl]butoxy]propan-2-yloxy]propan-2-yloxy]propan-2-yloxy]-2-methyl-propanenitrile
MOLECULAR FORMULA: C46H85N3O12
MOLECULAR WEIGHT: 872.18
SMILES: CCC(COCC(CC)(COCC(C)OCC(C)OCC(C)OCC(C)C#N)COCC(C)OCC(C)OCC(C)OCC(C)C#N)OCC(C)OCC(C)OCC(C)C#N
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