CAS RN: 71879-56-6
CAS Name: 4-pyridin-4-ylbutanoic acid hydrochloride
OPENEYE Name: 4-(4-pyridyl)butanoic acid hydrochloride
IUPAC Name: 4-pyridin-4-ylbutanoic acid hydrochloride
SYSTEMATIC NAME: 4-pyridin-4-ylbutanoic acid hydrochloride
MOLECULAR FORMULA: C9H12ClNO2
MOLECULAR WEIGHT: 201.65008
SMILES: C1=CN=CC=C1CCCC(=O)O.Cl
CAS RN: 1159824-29-9
CAS Name: (2-amino-2-methylpropyl)urea hydrochloride
OPENEYE Name: (2-amino-2-methyl-propyl)urea hydrochloride
IUPAC Name: (2-amino-2-methylpropyl)urea hydrochloride
SYSTEMATIC NAME: 1-(2-azanyl-2-methyl-propyl)urea hydrochloride
MOLECULAR FORMULA: C5H14ClN3O
MOLECULAR WEIGHT: 167.63716
SMILES: CC(C)(CNC(=O)N)N.Cl
CAS RN: 640280-28-0
CAS Name: 1-bromo-2-iodo-4-(trifluoromethyl)benzene
OPENEYE Name: 1-bromo-2-iodo-4-(trifluoromethyl)benzene
IUPAC Name: 1-bromo-2-iodo-4-(trifluoromethyl)benzene
SYSTEMATIC NAME: 1-bromanyl-2-iodanyl-4-(trifluoromethyl)benzene
MOLECULAR FORMULA: C7H3BrF3I
MOLECULAR WEIGHT: 350.9024
SMILES: C1=CC(=C(C=C1C(F)(F)F)I)Br
CAS RN: 89642-34-2
CAS Name: 1,2,5-tribromo-3-(trifluoromethyl)benzene
OPENEYE Name: 1,2,5-tribromo-3-(trifluoromethyl)benzene
IUPAC Name: 1,2,5-tribromo-3-(trifluoromethyl)benzene
SYSTEMATIC NAME: 1,2,5-tris(bromanyl)-3-(trifluoromethyl)benzene
MOLECULAR FORMULA: C7H2Br3F3
MOLECULAR WEIGHT: 382.79799
SMILES: C1=C(C=C(C(=C1Br)Br)C(F)(F)F)Br
CAS RN: 677777-56-9
CAS Name: 1-bromo-5-fluoro-4-iodo-2-methylbenzene
OPENEYE Name: 1-bromo-5-fluoro-4-iodo-2-methyl-benzene
IUPAC Name: 1-bromo-5-fluoro-4-iodo-2-methylbenzene
SYSTEMATIC NAME: 1-bromanyl-5-fluoranyl-4-iodanyl-2-methyl-benzene
MOLECULAR FORMULA: C7H5BrFI
MOLECULAR WEIGHT: 314.921473
SMILES: CC1=CC(=C(C=C1Br)F)I
CAS RN: 1027511-90-5
CAS Name: 1,2-dibromo-5-fluoro-3-(trifluoromethyl)benzene
OPENEYE Name: 1,2-dibromo-5-fluoro-3-(trifluoromethyl)benzene
IUPAC Name: 1,2-dibromo-5-fluoro-3-(trifluoromethyl)benzene
SYSTEMATIC NAME: 1,2-bis(bromanyl)-5-fluoranyl-3-(trifluoromethyl)benzene
MOLECULAR FORMULA: C7H2Br2F4
MOLECULAR WEIGHT: 321.892393
SMILES: C1=C(C=C(C(=C1Br)Br)C(F)(F)F)F
CAS RN: 548768-98-5
CAS Name: 4-(4-piperidinyl)aniline hydrochloride
OPENEYE Name: 4-(4-piperidyl)aniline hydrochloride
IUPAC Name: 4-piperidin-4-ylaniline hydrochloride
SYSTEMATIC NAME: 4-piperidin-4-ylaniline hydrochloride
MOLECULAR FORMULA: C11H17ClN2
MOLECULAR WEIGHT: 212.71908
SMILES: C1CNCCC1C2=CC=C(C=C2)N.Cl
CAS RN: 48108-93-6
CAS Name: 2-(2-aminoethyl)aniline hydrochloride
OPENEYE Name: 2-(2-aminoethyl)aniline hydrochloride
IUPAC Name: 2-(2-aminoethyl)aniline hydrochloride
SYSTEMATIC NAME: 2-(2-azanylethyl)aniline hydrochloride
MOLECULAR FORMULA: C8H13ClN2
MOLECULAR WEIGHT: 172.65522
SMILES: C1=CC=C(C(=C1)CCN)N.Cl
CAS RN: 319426-63-6
CAS Name: (2Z,4S,4aS,5aS,6S,12aS)-2-[amino(hydroxy)methylidene]-4-(dimethylamino)-6,11,12a-trihydroxy-6-methyl-10-[[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxy]-4,4a,5,5a-tetrahydrotetracene-1,3,12-trione
OPENEYE Name: (2Z,4S,4aS,5aS,6S,12aS)-2-[amino(hydroxy)methylene]-4-(dimethylamino)-6,11,12a-trihydroxy-6-methyl-10-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-4,4a,5,5a-tetrahydrotetracene-1,3,12-trione
IUPAC Name: (2Z,4S,4aS,5aS,6S,12aS)-2-[amino(hydroxy)methylidene]-4-(dimethylamino)-6,11,12a-trihydroxy-6-methyl-10-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,4a,5,5a-tetrahydrotetracene-1,3,12-trione
SYSTEMATIC NAME: (2Z,4S,4aS,5aS,6S,12aS)-2-[azanyl(oxidanyl)methylidene]-4-(dimethylamino)-10-[(2S,3R,4S,5R,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-6-methyl-6,11,12a-tris(oxidanyl)-4,4a,5,5a-tetrahydrotetracene-1,3,12-trione
MOLECULAR FORMULA: C28H34N2O13
MOLECULAR WEIGHT: 606.57516
SMILES: C[C@@]1([C@H]2C[C@H]3[C@@H](C(=O)/C(=C(\N)/O)/C(=O)[C@]3(C(=O)C2=C(C4=C1C=CC=C4O[C@H]5[C@@H]([C@H]([C@H]([C@H](O5)CO)O)O)O)O)O)N(C)C)O
CAS RN: 1758-80-1
CAS Name: (2S)-2,4-diaminobutanoic acid hydrobromide
OPENEYE Name: (2S)-2,4-diaminobutanoic acid hydrobromide
IUPAC Name: (2S)-2,4-diaminobutanoic acid hydrobromide
SYSTEMATIC NAME: (2S)-2,4-bis(azanyl)butanoic acid hydrobromide
MOLECULAR FORMULA: C4H11BrN2O2
MOLECULAR WEIGHT: 199.04634
SMILES: C(CN)[C@@H](C(=O)O)N.Br
CAS RN: 904326-93-8
CAS Name: [6-(4-morpholinyl)-3-pyridinyl]boronic acid
OPENEYE Name: (6-morpholino-3-pyridyl)boronic acid
IUPAC Name: (6-morpholin-4-ylpyridin-3-yl)boronic acid
SYSTEMATIC NAME: (6-morpholin-4-ylpyridin-3-yl)boronic acid
MOLECULAR FORMULA: C9H13BN2O3
MOLECULAR WEIGHT: 208.02212
SMILES: B(C1=CN=C(C=C1)N2CCOCC2)(O)O
CAS RN: 53913-82-9
CAS Name: 3-bromoazetidine hydrochloride
OPENEYE Name: 3-bromoazetidine hydrochloride
IUPAC Name: 3-bromoazetidine hydrochloride
SYSTEMATIC NAME: 3-bromanylazetidine hydrochloride
MOLECULAR FORMULA: C3H7BrClN
MOLECULAR WEIGHT: 172.45138
SMILES: C1C(CN1)Br.Cl
CAS RN: 1216282-97-1
CAS Name: 6-bromo-5-hydroxy-3-pyridinecarboxylic acid
OPENEYE Name: 6-bromo-5-hydroxy-pyridine-3-carboxylic acid
IUPAC Name: 6-bromo-5-hydroxypyridine-3-carboxylic acid
SYSTEMATIC NAME: 6-bromanyl-5-oxidanyl-pyridine-3-carboxylic acid
MOLECULAR FORMULA: C6H4BrNO3
MOLECULAR WEIGHT: 218.00486
SMILES: C1=C(C=NC(=C1O)Br)C(=O)O
CAS RN: 1203499-12-0
CAS Name: 1-(2-chloro-5-fluoro-3-pyridinyl)ethanone
OPENEYE Name: 1-(2-chloro-5-fluoro-3-pyridyl)ethanone
IUPAC Name: 1-(2-chloro-5-fluoropyridin-3-yl)ethanone
SYSTEMATIC NAME: 1-(2-chloranyl-5-fluoranyl-pyridin-3-yl)ethanone
MOLECULAR FORMULA: C7H5ClFNO
MOLECULAR WEIGHT: 173.572103
SMILES: CC(=O)C1=CC(=CN=C1Cl)F
CAS RN: 1214365-67-9
CAS Name: 2,4-dibromo-6-(trifluoromethyl)-3-pyridinamine
OPENEYE Name: 2,4-dibromo-6-(trifluoromethyl)pyridin-3-amine
IUPAC Name: 2,4-dibromo-6-(trifluoromethyl)pyridin-3-amine
SYSTEMATIC NAME: 2,4-bis(bromanyl)-6-(trifluoromethyl)pyridin-3-amine
MOLECULAR FORMULA: C6H3Br2F3N2
MOLECULAR WEIGHT: 319.90463
SMILES: C1=C(C(=C(N=C1C(F)(F)F)Br)N)Br
CAS RN: 1214383-04-6
CAS Name: 2,3,4-tribromo-6-(trifluoromethyl)pyridine
OPENEYE Name: 2,3,4-tribromo-6-(trifluoromethyl)pyridine
IUPAC Name: 2,3,4-tribromo-6-(trifluoromethyl)pyridine
SYSTEMATIC NAME: 2,3,4-tris(bromanyl)-6-(trifluoromethyl)pyridine
MOLECULAR FORMULA: C6HBr3F3N
MOLECULAR WEIGHT: 383.78605
SMILES: C1=C(C(=C(N=C1C(F)(F)F)Br)Br)Br
CAS RN: 1060815-21-5
CAS Name: 2,4-dichloro-6-(trifluoromethyl)-3-pyridinamine
OPENEYE Name: 2,4-dichloro-6-(trifluoromethyl)pyridin-3-amine
IUPAC Name: 2,4-dichloro-6-(trifluoromethyl)pyridin-3-amine
SYSTEMATIC NAME: 2,4-bis(chloranyl)-6-(trifluoromethyl)pyridin-3-amine
MOLECULAR FORMULA: C6H3Cl2F3N2
MOLECULAR WEIGHT: 231.00263
SMILES: C1=C(C(=C(N=C1C(F)(F)F)Cl)N)Cl
CAS RN: 852362-24-4
CAS Name: 4-pyrimidinylboronic acid
OPENEYE Name: pyrimidin-4-ylboronic acid
IUPAC Name: pyrimidin-4-ylboronic acid
SYSTEMATIC NAME: pyrimidin-4-ylboronic acid
MOLECULAR FORMULA: C4H5BN2O2
MOLECULAR WEIGHT: 123.9057
SMILES: B(C1=NC=NC=C1)(O)O
CAS RN: 1160994-90-0
CAS Name: 5-bromo-3-hydroxy-2-pyridinecarboxylic acid
OPENEYE Name: 5-bromo-3-hydroxy-pyridine-2-carboxylic acid
IUPAC Name: 5-bromo-3-hydroxypyridine-2-carboxylic acid
SYSTEMATIC NAME: 5-bromanyl-3-oxidanyl-pyridine-2-carboxylic acid
MOLECULAR FORMULA: C6H4BrNO3
MOLECULAR WEIGHT: 218.00486
SMILES: C1=C(C(=NC=C1Br)C(=O)O)O
CAS RN: 89571-66-4
CAS Name: 3-amino-5-(trifluoromethyl)-1H-pyridine-2-thione
OPENEYE Name: 3-amino-5-(trifluoromethyl)-1H-pyridine-2-thione
IUPAC Name: 3-amino-5-(trifluoromethyl)-1H-pyridine-2-thione
SYSTEMATIC NAME: 3-azanyl-5-(trifluoromethyl)-1H-pyridine-2-thione
MOLECULAR FORMULA: C6H5F3N2S
MOLECULAR WEIGHT: 194.17751
SMILES: C1=C(C(=S)NC=C1C(F)(F)F)N
CAS RN: 1060809-18-8
CAS Name: 4-fluoro-2-pyridinecarboxaldehyde
OPENEYE Name: 4-fluoropyridine-2-carbaldehyde
IUPAC Name: 4-fluoropyridine-2-carbaldehyde
SYSTEMATIC NAME: 4-fluoranylpyridine-2-carbaldehyde
MOLECULAR FORMULA: C6H4FNO
MOLECULAR WEIGHT: 125.100463
SMILES: C1=CN=C(C=C1F)C=O
CAS RN: 773136-55-3
CAS Name: 2-fluoro-6-methoxybenzoic acid ethyl ester
OPENEYE Name: ethyl 2-fluoro-6-methoxy-benzoate
IUPAC Name: ethyl 2-fluoro-6-methoxybenzoate
SYSTEMATIC NAME: ethyl 2-fluoranyl-6-methoxy-benzoate
MOLECULAR FORMULA: C10H11FO3
MOLECULAR WEIGHT: 198.190943
SMILES: CCOC(=O)C1=C(C=CC=C1F)OC
CAS RN: 773873-67-9
CAS Name: 2,3,6-trifluorobenzoic acid methyl ester
OPENEYE Name: methyl 2,3,6-trifluorobenzoate
IUPAC Name: methyl 2,3,6-trifluorobenzoate
SYSTEMATIC NAME: methyl 2,3,6-tris(fluoranyl)benzoate
MOLECULAR FORMULA: C8H5F3O2
MOLECULAR WEIGHT: 190.11931
SMILES: COC(=O)C1=C(C=CC(=C1F)F)F
CAS RN: 258834-37-6
CAS Name: sodium 2-[4-[(4-chlorophenyl)-oxomethyl]phenoxy]-2-methylpropanoate
OPENEYE Name: sodium 2-[4-(4-chlorobenzoyl)phenoxy]-2-methyl-propanoate
IUPAC Name: sodium 2-[4-(4-chlorobenzoyl)phenoxy]-2-methylpropanoate
SYSTEMATIC NAME: sodium 2-[4-(4-chlorophenyl)carbonylphenoxy]-2-methyl-propanoate
MOLECULAR FORMULA: C17H14ClNaO4
MOLECULAR WEIGHT: 340.73343
SMILES: CC(C)(C(=O)[O-])OC1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)Cl.[Na+]
CAS RN: 192642-85-6
CAS Name: 2-(5-bromo-2-pyridinyl)acetic acid
OPENEYE Name: 2-(5-bromo-2-pyridyl)acetic acid
IUPAC Name: 2-(5-bromopyridin-2-yl)acetic acid
SYSTEMATIC NAME: 2-(5-bromanylpyridin-2-yl)ethanoic acid
MOLECULAR FORMULA: C7H6BrNO2
MOLECULAR WEIGHT: 216.03204
SMILES: C1=CC(=NC=C1Br)CC(=O)O
CAS RN: 221167-39-1
CAS Name: 7-fluoro-3-oxo-4H-quinoxaline-2-carboxylic acid methyl ester
OPENEYE Name: methyl 7-fluoro-3-oxo-4H-quinoxaline-2-carboxylate
IUPAC Name: methyl 7-fluoro-3-oxo-4H-quinoxaline-2-carboxylate
SYSTEMATIC NAME: methyl 7-fluoranyl-3-oxidanylidene-4H-quinoxaline-2-carboxylate
MOLECULAR FORMULA: C10H7FN2O3
MOLECULAR WEIGHT: 222.172583
SMILES: COC(=O)C1=NC2=C(C=CC(=C2)F)NC1=O
CAS RN: 685517-84-4
CAS Name: 3,5-dibromo-2,6-difluoropyridine
OPENEYE Name: 3,5-dibromo-2,6-difluoro-pyridine
IUPAC Name: 3,5-dibromo-2,6-difluoropyridine
SYSTEMATIC NAME: 3,5-bis(bromanyl)-2,6-bis(fluoranyl)pyridine
MOLECULAR FORMULA: C5HBr2F2N
MOLECULAR WEIGHT: 272.872946
SMILES: C1=C(C(=NC(=C1Br)F)F)Br
CAS RN: 1049026-49-4
CAS Name: 2-bromo-5-(methylthio)pyrazine
OPENEYE Name: 2-bromo-5-methylsulfanyl-pyrazine
IUPAC Name: 2-bromo-5-methylsulfanylpyrazine
SYSTEMATIC NAME: 2-bromanyl-5-methylsulfanyl-pyrazine
MOLECULAR FORMULA: C5H5BrN2S
MOLECULAR WEIGHT: 205.0756
SMILES: CSC1=CN=C(C=N1)Br
CAS RN: 147208-69-3
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C14H25BClNO2
MOLECULAR WEIGHT: 285.6178
SMILES: B1(O[C@@H]2C[C@@H]3C[C@H]([C@@]2(O1)C)C3(C)C)[C@@H]4CCCN4.Cl
CAS RN: 141460-19-7
CAS Name: 2-(4-carboxy-2-pyridinyl)-4-pyridinecarboxylic acid; isothiocyanic acid; ruthenium
OPENEYE Name: 2-(4-carboxy-2-pyridyl)pyridine-4-carboxylic acid; isothiocyanic acid; ruthenium
IUPAC Name: 2-(4-carboxypyridin-2-yl)pyridine-4-carboxylic acid; isothiocyanic acid; ruthenium
SYSTEMATIC NAME: 2-(4-carboxypyridin-2-yl)pyridine-4-carboxylic acid; isothiocyanic acid; ruthenium
MOLECULAR FORMULA: C26H18N6O8RuS2
MOLECULAR WEIGHT: 707.65652
SMILES: C1=CN=C(C=C1C(=O)O)C2=NC=CC(=C2)C(=O)O.C1=CN=C(C=C1C(=O)O)C2=NC=CC(=C2)C(=O)O.C(=N)=S.C(=N)=S.[Ru]
CAS RN: 1206487-35-5
CAS Name: 4,6-dibromo-3-pyridazinamine
OPENEYE Name: 4,6-dibromopyridazin-3-amine
IUPAC Name: 4,6-dibromopyridazin-3-amine
SYSTEMATIC NAME: 4,6-bis(bromanyl)pyridazin-3-amine
MOLECULAR FORMULA: C4H3Br2N3
MOLECULAR WEIGHT: 252.89472
SMILES: C1=C(C(=NN=C1Br)N)Br
CAS RN: 34844-89-8
CAS Name: N-propan-2-yl-4-pyridinamine dihydrochloride
OPENEYE Name: N-isopropylpyridin-4-amine dihydrochloride
IUPAC Name: N-propan-2-ylpyridin-4-amine dihydrochloride
SYSTEMATIC NAME: N-propan-2-ylpyridin-4-amine dihydrochloride
MOLECULAR FORMULA: C8H14Cl2N2
MOLECULAR WEIGHT: 209.11616
SMILES: CC(C)NC1=CC=NC=C1.Cl.Cl
CAS RN: 32405-76-8
CAS Name: N-propan-2-yl-3-pyridinamine dihydrochloride
OPENEYE Name: N-isopropylpyridin-3-amine dihydrochloride
IUPAC Name: N-propan-2-ylpyridin-3-amine dihydrochloride
SYSTEMATIC NAME: N-propan-2-ylpyridin-3-amine dihydrochloride
MOLECULAR FORMULA: C8H14Cl2N2
MOLECULAR WEIGHT: 209.11616
SMILES: CC(C)NC1=CN=CC=C1.Cl.Cl
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