Product OPENEYE NAME: N-(4-acetylphenyl)-4-(4-oxo-6H-pyrazolo[1,5-a][1,3,5]triazin-2-yl)benzenesulfonamide
CAS Name: N-(4-acetylphenyl)-4-(4-oxo-6H-pyrazolo[1,5-a][1,3,5]triazin-2-yl)benzenesulfonamide
IUPAC NAME: N-(4-acetylphenyl)-4-(4-oxo-6H-pyrazolo[1,5-a][1,3,5]triazin-2-yl)benzenesulfonamide
SYSTEMATIC NAME: N-(4-ethanoylphenyl)-4-(4-oxidanylidene-6H-pyrazolo[1,5-a][1,3,5]triazin-2-yl)benzenesulfonamide
MOLECULAR FORMULA: C19H15N5O4S
MOLECULAR WEIGHT: 409.4185
SMILES: CC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)C3=NC(=O)N4C(=N3)C=CN4
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Product OPENEYE NAME: N-(2-ethylphenyl)-4-(4-oxo-6H-pyrazolo[1,5-a][1,3,5]triazin-2-yl)benzenesulfonamide
CAS Name: N-(2-ethylphenyl)-4-(4-oxo-6H-pyrazolo[1,5-a][1,3,5]triazin-2-yl)benzenesulfonamide
IUPAC NAME: N-(2-ethylphenyl)-4-(4-oxo-6H-pyrazolo[1,5-a][1,3,5]triazin-2-yl)benzenesulfonamide
SYSTEMATIC NAME: N-(2-ethylphenyl)-4-(4-oxidanylidene-6H-pyrazolo[1,5-a][1,3,5]triazin-2-yl)benzenesulfonamide
MOLECULAR FORMULA: C19H17N5O3S
MOLECULAR WEIGHT: 395.43498
SMILES: CCC1=CC=CC=C1NS(=O)(=O)C2=CC=C(C=C2)C3=NC(=O)N4C(=N3)C=CN4
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Product OPENEYE NAME: 2-[4-(5-aminopyrazol-1-yl)sulfonylphenyl]-6H-pyrazolo[1,5-a][1,3,5]triazin-4-one
CAS Name: 2-[4-[(5-amino-1-pyrazolyl)sulfonyl]phenyl]-6H-pyrazolo[1,5-a][1,3,5]triazin-4-one
IUPAC NAME: 2-[4-(5-aminopyrazol-1-yl)sulfonylphenyl]-6H-pyrazolo[1,5-a][1,3,5]triazin-4-one
SYSTEMATIC NAME: 2-[4-(5-azanylpyrazol-1-yl)sulfonylphenyl]-6H-pyrazolo[1,5-a][1,3,5]triazin-4-one
MOLECULAR FORMULA: C14H11N7O3S
MOLECULAR WEIGHT: 357.34724
SMILES: C1=CC(=CC=C1C2=NC(=O)N3C(=N2)C=CN3)S(=O)(=O)N4C(=CC=N4)N
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Product OPENEYE NAME: 2-[3,4-bis(methylsulfanyl)phenyl]-6H-pyrazolo[1,5-a][1,3,5]triazin-4-one
CAS Name: 2-[3,4-bis(methylthio)phenyl]-6H-pyrazolo[1,5-a][1,3,5]triazin-4-one
IUPAC NAME: 2-[3,4-bis(methylsulfanyl)phenyl]-6H-pyrazolo[1,5-a][1,3,5]triazin-4-one
SYSTEMATIC NAME: 2-[3,4-bis(methylsulfanyl)phenyl]-6H-pyrazolo[1,5-a][1,3,5]triazin-4-one
MOLECULAR FORMULA: C13H12N4OS2
MOLECULAR WEIGHT: 304.39058
SMILES: CSC1=C(C=C(C=C1)C2=NC(=O)N3C(=N2)C=CN3)SC
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Product OPENEYE NAME: pyrazol-1-ylthiourea
CAS Name: 1-pyrazolylthiourea
IUPAC NAME: pyrazol-1-ylthiourea
SYSTEMATIC NAME: 1-pyrazol-1-ylthiourea
MOLECULAR FORMULA: C4H6N4S
MOLECULAR WEIGHT: 142.18224
SMILES: C1=CN(N=C1)NC(=S)N
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Product OPENEYE NAME: 1-hydroxy-8-phenyl-4H-pyrazolo[1,5-a][1,3,5]triazine
CAS Name: 1-hydroxy-8-phenyl-4H-pyrazolo[1,5-a][1,3,5]triazine
IUPAC NAME: 1-hydroxy-8-phenyl-4H-pyrazolo[1,5-a][1,3,5]triazine
SYSTEMATIC NAME: 1-oxidanyl-8-phenyl-4H-pyrazolo[1,5-a][1,3,5]triazine
MOLECULAR FORMULA: C11H10N4O
MOLECULAR WEIGHT: 214.2233
SMILES: C1N=CN(C2=C(C=NN21)C3=CC=CC=C3)O
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Product OPENEYE NAME: N-(4-tert-butylphenyl)-4-(4-oxo-6H-pyrazolo[1,5-a][1,3,5]triazin-2-yl)benzenesulfonamide
CAS Name: N-(4-tert-butylphenyl)-4-(4-oxo-6H-pyrazolo[1,5-a][1,3,5]triazin-2-yl)benzenesulfonamide
IUPAC NAME: N-(4-tert-butylphenyl)-4-(4-oxo-6H-pyrazolo[1,5-a][1,3,5]triazin-2-yl)benzenesulfonamide
SYSTEMATIC NAME: N-(4-tert-butylphenyl)-4-(4-oxidanylidene-6H-pyrazolo[1,5-a][1,3,5]triazin-2-yl)benzenesulfonamide
MOLECULAR FORMULA: C21H21N5O3S
MOLECULAR WEIGHT: 423.48814
SMILES: CC(C)(C)C1=CC=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)C3=NC(=O)N4C(=N3)C=CN4
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Product OPENEYE NAME: 1-hydroxy-4H-pyrazolo[1,5-a][1,3,5]triazine
CAS Name: 1-hydroxy-4H-pyrazolo[1,5-a][1,3,5]triazine
IUPAC NAME: 1-hydroxy-4H-pyrazolo[1,5-a][1,3,5]triazine
SYSTEMATIC NAME: 1-oxidanyl-4H-pyrazolo[1,5-a][1,3,5]triazine
MOLECULAR FORMULA: C5H6N4O
MOLECULAR WEIGHT: 138.12734
SMILES: C1N=CN(C2=CC=NN21)O
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Product OPENEYE NAME: 1,3,5-triazine hydrate
CAS Name: 1,3,5-triazine hydrate
IUPAC NAME: 1,3,5-triazine hydrate
SYSTEMATIC NAME: 1,3,5-triazine hydrate
MOLECULAR FORMULA: C3H5N3O
MOLECULAR WEIGHT: 99.0913
SMILES: C1=NC=NC=N1.O
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Product OPENEYE NAME: 2-[(3,5,6-trichloro-2-pyridyl)oxy]acetate
CAS Name: 2-[(3,5,6-trichloro-2-pyridinyl)oxy]acetate
IUPAC NAME: 2-(3,5,6-trichloropyridin-2-yl)oxyacetate
SYSTEMATIC NAME: 2-[3,5,6-tris(chloranyl)pyridin-2-yl]oxyethanoate
MOLECULAR FORMULA: C7H3Cl3NO3-
MOLECULAR WEIGHT: 255.46262
SMILES: C1=C(C(=NC(=C1Cl)Cl)OCC(=O)[O-])Cl
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Product OPENEYE NAME: [[[1-(aminomethyl)-2-oxo-tridecyl]-(2-hydroxyethyl)amino]-carboxy-methyl]ammonium
CAS Name: [[(1-amino-3-oxotetradecan-2-yl)-(2-hydroxyethyl)amino]-carboxymethyl]ammonium
IUPAC NAME: [[(1-amino-3-oxotetradecan-2-yl)-(2-hydroxyethyl)amino]-carboxymethyl]azanium
SYSTEMATIC NAME: [1-[(1-azanyl-3-oxidanylidene-tetradecan-2-yl)-(2-hydroxyethyl)amino]-2-oxidanyl-2-oxidanylidene-ethyl]azanium
MOLECULAR FORMULA: C18H38N3O4+
MOLECULAR WEIGHT: 360.51202
SMILES: CCCCCCCCCCCC(=O)C(CN)N(CCO)C(C(=O)O)[NH3+]
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Product OPENEYE NAME: 2-amino-2-[[1-(aminomethyl)-2-oxo-tridecyl]-(2-hydroxyethyl)amino]acetic acid
CAS Name: 2-amino-2-[(1-amino-3-oxotetradecan-2-yl)-(2-hydroxyethyl)amino]acetic acid
IUPAC NAME: 2-amino-2-[(1-amino-3-oxotetradecan-2-yl)-(2-hydroxyethyl)amino]acetic acid
SYSTEMATIC NAME: 2-azanyl-2-[(1-azanyl-3-oxidanylidene-tetradecan-2-yl)-(2-hydroxyethyl)amino]ethanoic acid
MOLECULAR FORMULA: C18H37N3O4
MOLECULAR WEIGHT: 359.50408
SMILES: CCCCCCCCCCCC(=O)C(CN)N(CCO)C(C(=O)O)N
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Product OPENEYE NAME: N-(2-aminoethyl)-N-(1-hydroxyethyl)dodecanamide
CAS Name: N-(2-aminoethyl)-N-(1-hydroxyethyl)dodecanamide
IUPAC NAME: N-(2-aminoethyl)-N-(1-hydroxyethyl)dodecanamide
SYSTEMATIC NAME: N-(2-azanylethyl)-N-(1-hydroxyethyl)dodecanamide
MOLECULAR FORMULA: C16H34N2O2
MOLECULAR WEIGHT: 286.45336
SMILES: CCCCCCCCCCCC(=O)N(CCN)C(C)O
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Product OPENEYE NAME: N-(2-aminoethyl)-N-(1-hydroxyethyl)octadecanamide
CAS Name: N-(2-aminoethyl)-N-(1-hydroxyethyl)octadecanamide
IUPAC NAME: N-(2-aminoethyl)-N-(1-hydroxyethyl)octadecanamide
SYSTEMATIC NAME: N-(2-azanylethyl)-N-(1-hydroxyethyl)octadecanamide
MOLECULAR FORMULA: C22H46N2O2
MOLECULAR WEIGHT: 370.61284
SMILES: CCCCCCCCCCCCCCCCCC(=O)N(CCN)C(C)O
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Product OPENEYE NAME: 1-[2-(2-amino-6-oxo-7,8-dihydro-3H-purin-9-yl)ethoxy]ethylphosphonic acid
CAS Name: 1-[2-(2-amino-6-oxo-7,8-dihydro-3H-purin-9-yl)ethoxy]ethylphosphonic acid
IUPAC NAME: 1-[2-(2-amino-6-oxo-7,8-dihydro-3H-purin-9-yl)ethoxy]ethylphosphonic acid
SYSTEMATIC NAME: 1-[2-(2-azanyl-6-oxidanylidene-7,8-dihydro-3H-purin-9-yl)ethoxy]ethylphosphonic acid
MOLECULAR FORMULA: C9H16N5O5P
MOLECULAR WEIGHT: 305.227601
SMILES: CC(OCCN1CNC2=C1NC(=NC2=O)N)P(=O)(O)O
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Product OPENEYE NAME: 2-(2-amino-6-oxo-7,8-dihydro-3H-purin-9-yl)propoxymethylphosphonic acid
CAS Name: 2-(2-amino-6-oxo-7,8-dihydro-3H-purin-9-yl)propoxymethylphosphonic acid
IUPAC NAME: 2-(2-amino-6-oxo-7,8-dihydro-3H-purin-9-yl)propoxymethylphosphonic acid
SYSTEMATIC NAME: 2-(2-azanyl-6-oxidanylidene-7,8-dihydro-3H-purin-9-yl)propoxymethylphosphonic acid
MOLECULAR FORMULA: C9H16N5O5P
MOLECULAR WEIGHT: 305.227601
SMILES: CC(COCP(=O)(O)O)N1CNC2=C1NC(=NC2=O)N
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Product OPENEYE NAME: [1-[2-(2-amino-6-oxo-3H-purin-9-yl)ethoxy]-2-methyl-propyl]phosphonic acid
CAS Name: [1-[2-(2-amino-6-oxo-3H-purin-9-yl)ethoxy]-2-methylpropyl]phosphonic acid
IUPAC NAME: [1-[2-(2-amino-6-oxo-3H-purin-9-yl)ethoxy]-2-methylpropyl]phosphonic acid
SYSTEMATIC NAME: [1-[2-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)ethoxy]-2-methyl-propyl]phosphonic acid
MOLECULAR FORMULA: C11H18N5O5P
MOLECULAR WEIGHT: 331.264881
SMILES: CC(C)C(OCCN1C=NC2=C1NC(=NC2=O)N)P(=O)(O)O
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Product OPENEYE NAME: [3-(2-amino-6-oxo-7,8-dihydro-3H-purin-9-yl)-1-(hydroxymethyl)propoxy]methylphosphonic acid
CAS Name: [4-(2-amino-6-oxo-7,8-dihydro-3H-purin-9-yl)-1-hydroxybutan-2-yl]oxymethylphosphonic acid
IUPAC NAME: [4-(2-amino-6-oxo-7,8-dihydro-3H-purin-9-yl)-1-hydroxybutan-2-yl]oxymethylphosphonic acid
SYSTEMATIC NAME: [4-(2-azanyl-6-oxidanylidene-7,8-dihydro-3H-purin-9-yl)-1-oxidanyl-butan-2-yl]oxymethylphosphonic acid
MOLECULAR FORMULA: C10H18N5O6P
MOLECULAR WEIGHT: 335.253581
SMILES: C1NC2=C(N1CCC(CO)OCP(=O)(O)O)NC(=NC2=O)N
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Product OPENEYE NAME: [1-(1-bromobutoxy)-1-ethyl-propyl]phosphonic acid
CAS Name: 3-(1-bromobutoxy)pentan-3-ylphosphonic acid
IUPAC NAME: 3-(1-bromobutoxy)pentan-3-ylphosphonic acid
SYSTEMATIC NAME: 3-(1-bromanylbutoxy)pentan-3-ylphosphonic acid
MOLECULAR FORMULA: C9H20BrO4P
MOLECULAR WEIGHT: 303.130461
SMILES: CCCC(OC(CC)(CC)P(=O)(O)O)Br
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Product OPENEYE NAME: [1-(4-benzyloxy-3-hydroxy-butoxy)-1-ethyl-propyl]phosphonic acid
CAS Name: 3-(3-hydroxy-4-phenylmethoxybutoxy)pentan-3-ylphosphonic acid
IUPAC NAME: 3-(3-hydroxy-4-phenylmethoxybutoxy)pentan-3-ylphosphonic acid
SYSTEMATIC NAME: 3-(3-oxidanyl-4-phenylmethoxy-butoxy)pentan-3-ylphosphonic acid
MOLECULAR FORMULA: C16H27O6P
MOLECULAR WEIGHT: 346.355741
SMILES: CCC(CC)(OCCC(COCC1=CC=CC=C1)O)P(=O)(O)O
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