Wednesday, January 25, 2012

http://ChemLookup.com Compounds




CAS RN: 168152-67-8
CAS Name: 7-propyl-6-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]-1H-[1,2,4]triazolo[1,5-a]pyrimidine-5-thione
OPENEYE Name: 7-propyl-6-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]-1H-[1,2,4]triazolo[1,5-a]pyrimidine-5-thione
IUPAC Name: 7-propyl-6-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]-1H-[1,2,4]triazolo[1,5-a]pyrimidine-5-thione
SYSTEMATIC NAME: 7-propyl-6-[[4-[2-(2H-1,2,3,4-tetrazol-5-yl)phenyl]phenyl]methyl]-1H-[1,2,4]triazolo[1,5-a]pyrimidine-5-thione
MOLECULAR FORMULA: C22H20N8S
MOLECULAR WEIGHT: 428.5128
SMILES: CCCC1=C(C(=S)N=C2N1NC=N2)CC3=CC=C(C=C3)C4=CC=CC=C4C5=NNN=N5
Structure:

CAS RN: 168152-66-7
CAS Name: 7-propyl-6-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]-1H-[1,2,4]triazolo[1,5-a]pyrimidin-5-one
OPENEYE Name: 7-propyl-6-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]-1H-[1,2,4]triazolo[1,5-a]pyrimidin-5-one
IUPAC Name: 7-propyl-6-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]-1H-[1,2,4]triazolo[1,5-a]pyrimidin-5-one
SYSTEMATIC NAME: 7-propyl-6-[[4-[2-(2H-1,2,3,4-tetrazol-5-yl)phenyl]phenyl]methyl]-1H-[1,2,4]triazolo[1,5-a]pyrimidin-5-one
MOLECULAR FORMULA: C22H20N8O
MOLECULAR WEIGHT: 412.4472
SMILES: CCCC1=C(C(=O)N=C2N1NC=N2)CC3=CC=C(C=C3)C4=CC=CC=C4C5=NNN=N5
Structure:

CAS RN: 168127-38-6
CAS Name: 2-[4-[2-(4-chloroanilino)-4-thiazolyl]phenoxy]acetic acid
OPENEYE Name: 2-[4-[2-(4-chloroanilino)thiazol-4-yl]phenoxy]acetic acid
IUPAC Name: 2-[4-[2-(4-chloroanilino)-1,3-thiazol-4-yl]phenoxy]acetic acid
SYSTEMATIC NAME: 2-[4-[2-[(4-chlorophenyl)amino]-1,3-thiazol-4-yl]phenoxy]ethanoic acid
MOLECULAR FORMULA: C17H13ClN2O3S
MOLECULAR WEIGHT: 360.81472
SMILES: C1=CC(=CC=C1C2=CSC(=N2)NC3=CC=C(C=C3)Cl)OCC(=O)O
Structure:

CAS RN: 168127-37-5
CAS Name: 2-[4-[2-(4-methylanilino)-4-thiazolyl]phenoxy]acetic acid
OPENEYE Name: 2-[4-[2-(4-methylanilino)thiazol-4-yl]phenoxy]acetic acid
IUPAC Name: 2-[4-[2-(4-methylanilino)-1,3-thiazol-4-yl]phenoxy]acetic acid
SYSTEMATIC NAME: 2-[4-[2-[(4-methylphenyl)amino]-1,3-thiazol-4-yl]phenoxy]ethanoic acid
MOLECULAR FORMULA: C18H16N2O3S
MOLECULAR WEIGHT: 340.39624
SMILES: CC1=CC=C(C=C1)NC2=NC(=CS2)C3=CC=C(C=C3)OCC(=O)O
Structure:

CAS RN: 168127-36-4
CAS Name: 2-[4-[2-(4-methoxyanilino)-4-thiazolyl]phenoxy]acetic acid
OPENEYE Name: 2-[4-[2-(4-methoxyanilino)thiazol-4-yl]phenoxy]acetic acid
IUPAC Name: 2-[4-[2-(4-methoxyanilino)-1,3-thiazol-4-yl]phenoxy]acetic acid
SYSTEMATIC NAME: 2-[4-[2-[(4-methoxyphenyl)amino]-1,3-thiazol-4-yl]phenoxy]ethanoic acid
MOLECULAR FORMULA: C18H16N2O4S
MOLECULAR WEIGHT: 356.39564
SMILES: COC1=CC=C(C=C1)NC2=NC(=CS2)C3=CC=C(C=C3)OCC(=O)O
Structure:

CAS RN: 168127-35-3
CAS Name: 2-[4-(2-anilino-4-thiazolyl)phenoxy]acetic acid
OPENEYE Name: 2-[4-(2-anilinothiazol-4-yl)phenoxy]acetic acid
IUPAC Name: 2-[4-(2-anilino-1,3-thiazol-4-yl)phenoxy]acetic acid
SYSTEMATIC NAME: 2-[4-(2-phenylazanyl-1,3-thiazol-4-yl)phenoxy]ethanoic acid
MOLECULAR FORMULA: C17H14N2O3S
MOLECULAR WEIGHT: 326.36966
SMILES: C1=CC=C(C=C1)NC2=NC(=CS2)C3=CC=C(C=C3)OCC(=O)O
Structure:

CAS RN: 168127-34-2
CAS Name: 2-[4-(2-amino-4-thiazolyl)phenoxy]acetic acid
OPENEYE Name: 2-[4-(2-aminothiazol-4-yl)phenoxy]acetic acid
IUPAC Name: 2-[4-(2-amino-1,3-thiazol-4-yl)phenoxy]acetic acid
SYSTEMATIC NAME: 2-[4-(2-azanyl-1,3-thiazol-4-yl)phenoxy]ethanoic acid
MOLECULAR FORMULA: C11H10N2O3S
MOLECULAR WEIGHT: 250.2737
SMILES: C1=CC(=CC=C1C2=CSC(=N2)N)OCC(=O)O
Structure:

CAS RN: 168127-33-1
CAS Name: 2-[4-[2-(4-chloroanilino)-4-thiazolyl]phenoxy]acetic acid ethyl ester
OPENEYE Name: ethyl 2-[4-[2-(4-chloroanilino)thiazol-4-yl]phenoxy]acetate
IUPAC Name: ethyl 2-[4-[2-(4-chloroanilino)-1,3-thiazol-4-yl]phenoxy]acetate
SYSTEMATIC NAME: ethyl 2-[4-[2-[(4-chlorophenyl)amino]-1,3-thiazol-4-yl]phenoxy]ethanoate
MOLECULAR FORMULA: C19H17ClN2O3S
MOLECULAR WEIGHT: 388.86788
SMILES: CCOC(=O)COC1=CC=C(C=C1)C2=CSC(=N2)NC3=CC=C(C=C3)Cl
Structure:

CAS RN: 168127-32-0
CAS Name: 2-[4-[2-(4-methylanilino)-4-thiazolyl]phenoxy]acetic acid ethyl ester
OPENEYE Name: ethyl 2-[4-[2-(4-methylanilino)thiazol-4-yl]phenoxy]acetate
IUPAC Name: ethyl 2-[4-[2-(4-methylanilino)-1,3-thiazol-4-yl]phenoxy]acetate
SYSTEMATIC NAME: ethyl 2-[4-[2-[(4-methylphenyl)amino]-1,3-thiazol-4-yl]phenoxy]ethanoate
MOLECULAR FORMULA: C20H20N2O3S
MOLECULAR WEIGHT: 368.4494
SMILES: CCOC(=O)COC1=CC=C(C=C1)C2=CSC(=N2)NC3=CC=C(C=C3)C
Structure:

CAS RN: 168127-31-9
CAS Name: 2-[4-[2-(4-methoxyanilino)-4-thiazolyl]phenoxy]acetic acid ethyl ester
OPENEYE Name: ethyl 2-[4-[2-(4-methoxyanilino)thiazol-4-yl]phenoxy]acetate
IUPAC Name: ethyl 2-[4-[2-(4-methoxyanilino)-1,3-thiazol-4-yl]phenoxy]acetate
SYSTEMATIC NAME: ethyl 2-[4-[2-[(4-methoxyphenyl)amino]-1,3-thiazol-4-yl]phenoxy]ethanoate
MOLECULAR FORMULA: C20H20N2O4S
MOLECULAR WEIGHT: 384.4488
SMILES: CCOC(=O)COC1=CC=C(C=C1)C2=CSC(=N2)NC3=CC=C(C=C3)OC
Structure:

CAS RN: 168127-30-8
CAS Name: 2-[4-(2-anilino-4-thiazolyl)phenoxy]acetic acid ethyl ester
OPENEYE Name: ethyl 2-[4-(2-anilinothiazol-4-yl)phenoxy]acetate
IUPAC Name: ethyl 2-[4-(2-anilino-1,3-thiazol-4-yl)phenoxy]acetate
SYSTEMATIC NAME: ethyl 2-[4-(2-phenylazanyl-1,3-thiazol-4-yl)phenoxy]ethanoate
MOLECULAR FORMULA: C19H18N2O3S
MOLECULAR WEIGHT: 354.42282
SMILES: CCOC(=O)COC1=CC=C(C=C1)C2=CSC(=N2)NC3=CC=CC=C3
Structure:

CAS RN: 168127-29-5
CAS Name: 2-[4-(2-amino-4-thiazolyl)phenoxy]acetic acid ethyl ester
OPENEYE Name: ethyl 2-[4-(2-aminothiazol-4-yl)phenoxy]acetate
IUPAC Name: ethyl 2-[4-(2-amino-1,3-thiazol-4-yl)phenoxy]acetate
SYSTEMATIC NAME: ethyl 2-[4-(2-azanyl-1,3-thiazol-4-yl)phenoxy]ethanoate
MOLECULAR FORMULA: C13H14N2O3S
MOLECULAR WEIGHT: 278.32686
SMILES: CCOC(=O)COC1=CC=C(C=C1)C2=CSC(=N2)N
Structure:

CAS RN: 168037-92-1
CAS Name: (2R)-3-[2-(3,4-dimethoxyphenyl)-1,3-dithian-2-yl]-N-[2-(3,4-dimethoxyphenyl)ethyl]-N,2-dimethyl-1-propanamine
OPENEYE Name: (2R)-3-[2-(3,4-dimethoxyphenyl)-1,3-dithian-2-yl]-N-[2-(3,4-dimethoxyphenyl)ethyl]-N,2-dimethyl-propan-1-amine
IUPAC Name: (2R)-3-[2-(3,4-dimethoxyphenyl)-1,3-dithian-2-yl]-N-[2-(3,4-dimethoxyphenyl)ethyl]-N,2-dimethylpropan-1-amine
SYSTEMATIC NAME: (2R)-3-[2-(3,4-dimethoxyphenyl)-1,3-dithian-2-yl]-N-[2-(3,4-dimethoxyphenyl)ethyl]-N,2-dimethyl-propan-1-amine
MOLECULAR FORMULA: C27H39NO4S2
MOLECULAR WEIGHT: 505.73286
SMILES: C[C@H](CC1(SCCCS1)C2=CC(=C(C=C2)OC)OC)CN(C)CCC3=CC(=C(C=C3)OC)OC
Structure:

CAS RN: 167542-69-0
CAS Name: 6-[(2-bromophenyl)-(7-hydroxy-4,9-dimethoxy-5-oxo-6-furo[3,2-g][1]benzopyranyl)methyl]-7-hydroxy-4,9-dimethoxy-5-furo[3,2-g][1]benzopyranone
OPENEYE Name: 6-[(2-bromophenyl)-(7-hydroxy-4,9-dimethoxy-5-oxo-furo[3,2-g]chromen-6-yl)methyl]-7-hydroxy-4,9-dimethoxy-furo[3,2-g]chromen-5-one
IUPAC Name: 6-[(2-bromophenyl)-(7-hydroxy-4,9-dimethoxy-5-oxofuro[3,2-g]chromen-6-yl)methyl]-7-hydroxy-4,9-dimethoxyfuro[3,2-g]chromen-5-one
SYSTEMATIC NAME: 6-[(2-bromophenyl)-(4,9-dimethoxy-7-oxidanyl-5-oxidanylidene-furo[3,2-g]chromen-6-yl)methyl]-4,9-dimethoxy-7-oxidanyl-furo[3,2-g]chromen-5-one
MOLECULAR FORMULA: C33H23BrO12
MOLECULAR WEIGHT: 691.43252
SMILES: COC1=C2C(=C(C3=C1C=CO3)OC)OC(=C(C2=O)C(C4=CC=CC=C4Br)C5=C(OC6=C(C7=C(C=CO7)C(=C6C5=O)OC)OC)O)O
Structure:

CAS RN: 167542-64-5
CAS Name: 6-[(2-chlorophenyl)-(7-hydroxy-4-methoxy-5-oxo-6-furo[3,2-g][1]benzopyranyl)methyl]-7-hydroxy-4-methoxy-5-furo[3,2-g][1]benzopyranone
OPENEYE Name: 6-[(2-chlorophenyl)-(7-hydroxy-4-methoxy-5-oxo-furo[3,2-g]chromen-6-yl)methyl]-7-hydroxy-4-methoxy-furo[3,2-g]chromen-5-one
IUPAC Name: 6-[(2-chlorophenyl)-(7-hydroxy-4-methoxy-5-oxofuro[3,2-g]chromen-6-yl)methyl]-7-hydroxy-4-methoxyfuro[3,2-g]chromen-5-one
SYSTEMATIC NAME: 6-[(2-chlorophenyl)-(4-methoxy-7-oxidanyl-5-oxidanylidene-furo[3,2-g]chromen-6-yl)methyl]-4-methoxy-7-oxidanyl-furo[3,2-g]chromen-5-one
MOLECULAR FORMULA: C31H19ClO10
MOLECULAR WEIGHT: 586.92956
SMILES: COC1=C2C=COC2=CC3=C1C(=O)C(=C(O3)O)C(C4=CC=CC=C4Cl)C5=C(OC6=C(C5=O)C(=C7C=COC7=C6)OC)O
Structure:

CAS RN: 167375-28-2
CAS Name: 2-[4-[(7-oxo-5-propyl-1H-pyrazolo[1,5-a]pyrimidin-6-yl)methyl]phenyl]benzoic acid
OPENEYE Name: 2-[4-[(7-oxo-5-propyl-1H-pyrazolo[1,5-a]pyrimidin-6-yl)methyl]phenyl]benzoic acid
IUPAC Name: 2-[4-[(7-oxo-5-propyl-1H-pyrazolo[1,5-a]pyrimidin-6-yl)methyl]phenyl]benzoic acid
SYSTEMATIC NAME: 2-[4-[(7-oxidanylidene-5-propyl-1H-pyrazolo[1,5-a]pyrimidin-6-yl)methyl]phenyl]benzoic acid
MOLECULAR FORMULA: C23H21N3O3
MOLECULAR WEIGHT: 387.43114
SMILES: CCCC1=C(C(=O)N2C(=N1)C=CN2)CC3=CC=C(C=C3)C4=CC=CC=C4C(=O)O
Structure:

CAS RN: 167375-27-1
CAS Name: 2-[4-[(7-oxo-5-propyl-1H-pyrazolo[1,5-a]pyrimidin-6-yl)methyl]phenyl]benzamide
OPENEYE Name: 2-[4-[(7-oxo-5-propyl-1H-pyrazolo[1,5-a]pyrimidin-6-yl)methyl]phenyl]benzamide
IUPAC Name: 2-[4-[(7-oxo-5-propyl-1H-pyrazolo[1,5-a]pyrimidin-6-yl)methyl]phenyl]benzamide
SYSTEMATIC NAME: 2-[4-[(7-oxidanylidene-5-propyl-1H-pyrazolo[1,5-a]pyrimidin-6-yl)methyl]phenyl]benzamide
MOLECULAR FORMULA: C23H22N4O2
MOLECULAR WEIGHT: 386.44638
SMILES: CCCC1=C(C(=O)N2C(=N1)C=CN2)CC3=CC=C(C=C3)C4=CC=CC=C4C(=O)N
Structure:

CAS RN: 167375-26-0
CAS Name: 5,7-dipropyl-6-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]pyrazolo[1,5-a]pyrimidine
OPENEYE Name: 5,7-dipropyl-6-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]pyrazolo[1,5-a]pyrimidine
IUPAC Name: 5,7-dipropyl-6-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]pyrazolo[1,5-a]pyrimidine
SYSTEMATIC NAME: 5,7-dipropyl-6-[[4-[2-(2H-1,2,3,4-tetrazol-5-yl)phenyl]phenyl]methyl]pyrazolo[1,5-a]pyrimidine
MOLECULAR FORMULA: C26H27N7
MOLECULAR WEIGHT: 437.53948
SMILES: CCCC1=C(C(=NC2=CC=NN21)CCC)CC3=CC=C(C=C3)C4=CC=CC=C4C5=NNN=N5
Structure:

CAS RN: 167375-24-8
CAS Name: 5-butyl-6-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]-1H-pyrazolo[1,5-a]pyrimidin-7-one
OPENEYE Name: 5-butyl-6-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]-1H-pyrazolo[1,5-a]pyrimidin-7-one
IUPAC Name: 5-butyl-6-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]-1H-pyrazolo[1,5-a]pyrimidin-7-one
SYSTEMATIC NAME: 5-butyl-6-[[4-[2-(2H-1,2,3,4-tetrazol-5-yl)phenyl]phenyl]methyl]-1H-pyrazolo[1,5-a]pyrimidin-7-one
MOLECULAR FORMULA: C24H23N7O
MOLECULAR WEIGHT: 425.48572
SMILES: CCCCC1=C(C(=O)N2C(=N1)C=CN2)CC3=CC=C(C=C3)C4=CC=CC=C4C5=NNN=N5
Structure:

CAS RN: 167375-22-6
CAS Name: 7-propyl-6-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]-1H-pyrazolo[1,5-a]pyrimidin-5-one
OPENEYE Name: 7-propyl-6-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]-1H-pyrazolo[1,5-a]pyrimidin-5-one
IUPAC Name: 7-propyl-6-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]-1H-pyrazolo[1,5-a]pyrimidin-5-one
SYSTEMATIC NAME: 7-propyl-6-[[4-[2-(2H-1,2,3,4-tetrazol-5-yl)phenyl]phenyl]methyl]-1H-pyrazolo[1,5-a]pyrimidin-5-one
MOLECULAR FORMULA: C23H21N7O
MOLECULAR WEIGHT: 411.45914
SMILES: CCCC1=C(C(=O)N=C2N1NC=C2)CC3=CC=C(C=C3)C4=CC=CC=C4C5=NNN=N5
Structure:

CAS RN: 167309-33-3
CAS Name: [1-[(7-methyl-[1,2,4]triazolo[1,5-b]pyridazin-6-yl)oxymethyl]cyclohexyl]methanesulfonamide
OPENEYE Name: [1-[(7-methyl-[1,2,4]triazolo[1,5-b]pyridazin-6-yl)oxymethyl]cyclohexyl]methanesulfonamide
IUPAC Name: [1-[(7-methyl-[1,2,4]triazolo[1,5-b]pyridazin-6-yl)oxymethyl]cyclohexyl]methanesulfonamide
SYSTEMATIC NAME: [1-[(7-methyl-[1,2,4]triazolo[1,5-b]pyridazin-6-yl)oxymethyl]cyclohexyl]methanesulfonamide
MOLECULAR FORMULA: C14H21N5O3S
MOLECULAR WEIGHT: 339.41324
SMILES: CC1=CC2=NC=NN2N=C1OCC3(CCCCC3)CS(=O)(=O)N
Structure:

CAS RN: 167224-20-6
CAS Name: 5-[4-(2,4,7-triamino-6-pteridinyl)phenoxy]pentanoic acid propyl ester
OPENEYE Name: propyl 5-[4-(2,4,7-triaminopteridin-6-yl)phenoxy]pentanoate
IUPAC Name: propyl 5-[4-(2,4,7-triaminopteridin-6-yl)phenoxy]pentanoate
SYSTEMATIC NAME: propyl 5-[4-[2,4,7-tris(azanyl)pteridin-6-yl]phenoxy]pentanoate
MOLECULAR FORMULA: C20H25N7O3
MOLECULAR WEIGHT: 411.4576
SMILES: CCCOC(=O)CCCCOC1=CC=C(C=C1)C2=NC3=C(N=C2N)N=C(N=C3N)N
Structure:

CAS RN: 167224-19-3
CAS Name: 6-[4-[2-(4-morpholinyl)ethoxy]phenyl]pteridine-2,4,7-triamine
OPENEYE Name: 6-[4-(2-morpholinoethoxy)phenyl]pteridine-2,4,7-triamine
IUPAC Name: 6-[4-(2-morpholin-4-ylethoxy)phenyl]pteridine-2,4,7-triamine
SYSTEMATIC NAME: 6-[4-(2-morpholin-4-ylethoxy)phenyl]pteridine-2,4,7-triamine
MOLECULAR FORMULA: C18H22N8O2
MOLECULAR WEIGHT: 382.41968
SMILES: C1COCCN1CCOC2=CC=C(C=C2)C3=NC4=C(N=C3N)N=C(N=C4N)N
Structure:

CAS RN: 167224-18-2
CAS Name: 6-[4-[2-(1-pyrrolidinyl)ethoxy]phenyl]pteridine-2,4,7-triamine
OPENEYE Name: 6-[4-(2-pyrrolidin-1-ylethoxy)phenyl]pteridine-2,4,7-triamine
IUPAC Name: 6-[4-(2-pyrrolidin-1-ylethoxy)phenyl]pteridine-2,4,7-triamine
SYSTEMATIC NAME: 6-[4-(2-pyrrolidin-1-ylethoxy)phenyl]pteridine-2,4,7-triamine
MOLECULAR FORMULA: C18H22N8O
MOLECULAR WEIGHT: 366.42028
SMILES: C1CCN(C1)CCOC2=CC=C(C=C2)C3=NC4=C(N=C3N)N=C(N=C4N)N
Structure:

CAS RN: 167224-17-1
CAS Name: 6-[4-[2-[di(propan-2-yl)amino]ethoxy]phenyl]pteridine-2,4,7-triamine
OPENEYE Name: 6-[4-[2-(diisopropylamino)ethoxy]phenyl]pteridine-2,4,7-triamine
IUPAC Name: 6-[4-[2-[di(propan-2-yl)amino]ethoxy]phenyl]pteridine-2,4,7-triamine
SYSTEMATIC NAME: 6-[4-[2-[di(propan-2-yl)amino]ethoxy]phenyl]pteridine-2,4,7-triamine
MOLECULAR FORMULA: C20H28N8O
MOLECULAR WEIGHT: 396.48932
SMILES: CC(C)N(CCOC1=CC=C(C=C1)C2=NC3=C(N=C2N)N=C(N=C3N)N)C(C)C
Structure:

CAS RN: 166772-86-7
CAS Name: 1-[2-[4-(2-methylphenyl)-1-piperazinyl]ethyl]-4,5-dihydroimidazol-2-amine hydrobromide
OPENEYE Name: 1-[2-[4-(o-tolyl)piperazin-1-yl]ethyl]-4,5-dihydroimidazol-2-amine hydrobromide
IUPAC Name: 1-[2-[4-(2-methylphenyl)piperazin-1-yl]ethyl]-4,5-dihydroimidazol-2-amine hydrobromide
SYSTEMATIC NAME: 1-[2-[4-(2-methylphenyl)piperazin-1-yl]ethyl]-4,5-dihydroimidazol-2-amine hydrobromide
MOLECULAR FORMULA: C16H26BrN5
MOLECULAR WEIGHT: 368.31514
SMILES: CC1=CC=CC=C1N2CCN(CC2)CCN3CCN=C3N.Br
Structure:

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