CAS RN: 886745-59-1
CAS Name: 5-methoxy-4-nitro-1,3-benzothiazole-2-carboxylic acid
OPENEYE Name: 5-methoxy-4-nitro-1,3-benzothiazole-2-carboxylic acid
IUPAC Name: 5-methoxy-4-nitro-1,3-benzothiazole-2-carboxylic acid
SYSTEMATIC NAME: 5-methoxy-4-nitro-1,3-benzothiazole-2-carboxylic acid
MOLECULAR FORMULA: C9H6N2O5S
MOLECULAR WEIGHT: 254.21934
SMILES: COC1=C(C2=C(C=C1)SC(=N2)C(=O)O)[N+](=O)[O-]
CAS RN: 1075727-06-8
CAS Name: benzenesulfonate; 3-[(1R,2R)-1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-2-ium-2-yl]propanoic acid
OPENEYE Name: benzenesulfonate; 3-[(1R,2R)-1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-2-ium-2-yl]propanoic acid
IUPAC Name: benzenesulfonate; 3-[(1R,2R)-1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-2-ium-2-yl]propanoic acid
SYSTEMATIC NAME: benzenesulfonate; 3-[(1R,2R)-1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-2-ium-2-yl]propanoic acid
MOLECULAR FORMULA: C30H37NO9S
MOLECULAR WEIGHT: 587.68108
SMILES: C[N@@+]1(CCC2=CC(=C(C=C2[C@H]1CC3=CC(=C(C=C3)OC)OC)OC)OC)CCC(=O)O.C1=CC=C(C=C1)S(=O)(=O)[O-]
CAS RN: 371945-06-1
CAS Name: 2-amino-3-furo[2,3-b]pyridinecarboxylic acid ethyl ester
OPENEYE Name: ethyl 2-aminofuro[2,3-b]pyridine-3-carboxylate
IUPAC Name: ethyl 2-aminofuro[2,3-b]pyridine-3-carboxylate
SYSTEMATIC NAME: ethyl 2-azanylfuro[2,3-b]pyridine-3-carboxylate
MOLECULAR FORMULA: C10H10N2O3
MOLECULAR WEIGHT: 206.198
SMILES: CCOC(=O)C1=C(OC2=C1C=CC=N2)N
CAS RN: 98141-15-2
CAS Name: 7H-purin-6-ylmethanamine
OPENEYE Name: 7H-purin-6-ylmethanamine
IUPAC Name: 7H-purin-6-ylmethanamine
SYSTEMATIC NAME: 7H-purin-6-ylmethanamine
MOLECULAR FORMULA: C6H7N5
MOLECULAR WEIGHT: 149.15328
SMILES: C1=NC2=NC=NC(=C2N1)CN
CAS RN: 859199-06-7
CAS Name: 1-(5-bromo-4-methyl-2-thiophenyl)ethanone
OPENEYE Name: 1-(5-bromo-4-methyl-2-thienyl)ethanone
IUPAC Name: 1-(5-bromo-4-methylthiophen-2-yl)ethanone
SYSTEMATIC NAME: 1-(5-bromanyl-4-methyl-thiophen-2-yl)ethanone
MOLECULAR FORMULA: C7H7BrOS
MOLECULAR WEIGHT: 219.09888
SMILES: CC1=C(SC(=C1)C(=O)C)Br
CAS RN: 886372-63-0
CAS Name: 5-fluoro-6-methoxy-3-pyridinamine
OPENEYE Name: 5-fluoro-6-methoxy-pyridin-3-amine
IUPAC Name: 5-fluoro-6-methoxypyridin-3-amine
SYSTEMATIC NAME: 5-fluoranyl-6-methoxy-pyridin-3-amine
MOLECULAR FORMULA: C6H7FN2O
MOLECULAR WEIGHT: 142.130983
SMILES: COC1=C(C=C(C=N1)N)F
CAS RN: 22255-16-9
CAS Name: (1R,5S)-3-azabicyclo[3.1.0]hexane-4-carboxylic acid
OPENEYE Name: (1R,5S)-3-azabicyclo[3.1.0]hexane-4-carboxylic acid
IUPAC Name: (1R,5S)-3-azabicyclo[3.1.0]hexane-4-carboxylic acid
SYSTEMATIC NAME: (1R,5S)-3-azabicyclo[3.1.0]hexane-4-carboxylic acid
MOLECULAR FORMULA: C6H9NO2
MOLECULAR WEIGHT: 127.14116
SMILES: C1[C@@H]2[C@H]1C(NC2)C(=O)O
CAS RN: 921630-14-0
CAS Name: 2-bromo-5-chloro-4-pyridinecarboxaldehyde
OPENEYE Name: 2-bromo-5-chloro-pyridine-4-carbaldehyde
IUPAC Name: 2-bromo-5-chloropyridine-4-carbaldehyde
SYSTEMATIC NAME: 2-bromanyl-5-chloranyl-pyridine-4-carbaldehyde
MOLECULAR FORMULA: C6H3BrClNO
MOLECULAR WEIGHT: 220.45112
SMILES: C1=C(C(=CN=C1Br)Cl)C=O
CAS RN: 885278-62-6
CAS Name: 5-phenylmethoxy-1H-indazole-3-carboxylic acid methyl ester
OPENEYE Name: methyl 5-benzyloxy-1H-indazole-3-carboxylate
IUPAC Name: methyl 5-phenylmethoxy-1H-indazole-3-carboxylate
SYSTEMATIC NAME: methyl 5-phenylmethoxy-1H-indazole-3-carboxylate
MOLECULAR FORMULA: C16H14N2O3
MOLECULAR WEIGHT: 282.29396
SMILES: COC(=O)C1=NNC2=C1C=C(C=C2)OCC3=CC=CC=C3
CAS RN: 904086-08-4
CAS Name: 3-methyl-2H-indazol-5-ol
OPENEYE Name: 3-methyl-2H-indazol-5-ol
IUPAC Name: 3-methyl-2H-indazol-5-ol
SYSTEMATIC NAME: 3-methyl-2H-indazol-5-ol
MOLECULAR FORMULA: C8H8N2O
MOLECULAR WEIGHT: 148.16192
SMILES: CC1=C2C=C(C=CC2=NN1)O
CAS RN: 90915-65-4
CAS Name: 5-methoxy-1H-indazole-3-carboxylic acid methyl ester
OPENEYE Name: methyl 5-methoxy-1H-indazole-3-carboxylate
IUPAC Name: methyl 5-methoxy-1H-indazole-3-carboxylate
SYSTEMATIC NAME: methyl 5-methoxy-1H-indazole-3-carboxylate
MOLECULAR FORMULA: C10H10N2O3
MOLECULAR WEIGHT: 206.198
SMILES: COC1=CC2=C(C=C1)NN=C2C(=O)OC
CAS RN: 115661-89-7
CAS Name: 3,4-dihydro-2H-1,4-benzoxazine-8-carbonitrile hydrochloride
OPENEYE Name: 3,4-dihydro-2H-1,4-benzoxazine-8-carbonitrile hydrochloride
IUPAC Name: 3,4-dihydro-2H-1,4-benzoxazine-8-carbonitrile hydrochloride
SYSTEMATIC NAME: 3,4-dihydro-2H-1,4-benzoxazine-8-carbonitrile hydrochloride
MOLECULAR FORMULA: C9H9ClN2O
MOLECULAR WEIGHT: 196.63356
SMILES: C1COC2=C(C=CC=C2N1)C#N.Cl
CAS RN: 885276-77-7
CAS Name: 7-bromo-3-pyrazolo[1,5-a]pyridinecarboxylic acid ethyl ester
OPENEYE Name: ethyl 7-bromopyrazolo[1,5-a]pyridine-3-carboxylate
IUPAC Name: ethyl 7-bromopyrazolo[1,5-a]pyridine-3-carboxylate
SYSTEMATIC NAME: ethyl 7-bromanylpyrazolo[1,5-a]pyridine-3-carboxylate
MOLECULAR FORMULA: C10H9BrN2O2
MOLECULAR WEIGHT: 269.09466
SMILES: CCOC(=O)C1=C2C=CC=C(N2N=C1)Br
CAS RN: 885276-41-5
CAS Name: 6-methoxy-3-pyrazolo[1,5-a]pyridinecarboxylic acid ethyl ester
OPENEYE Name: ethyl 6-methoxypyrazolo[1,5-a]pyridine-3-carboxylate
IUPAC Name: ethyl 6-methoxypyrazolo[1,5-a]pyridine-3-carboxylate
SYSTEMATIC NAME: ethyl 6-methoxypyrazolo[1,5-a]pyridine-3-carboxylate
MOLECULAR FORMULA: C11H12N2O3
MOLECULAR WEIGHT: 220.22458
SMILES: CCOC(=O)C1=C2C=CC(=CN2N=C1)OC
CAS RN: 741709-58-0
CAS Name: 1-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-pyridinyl]ethanone
OPENEYE Name: 1-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-pyridyl]ethanone
IUPAC Name: 1-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl]ethanone
SYSTEMATIC NAME: 1-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl]ethanone
MOLECULAR FORMULA: C13H18BNO3
MOLECULAR WEIGHT: 247.09792
SMILES: B1(OC(C(O1)(C)C)(C)C)C2=CC(=NC=C2)C(=O)C
CAS RN: 903551-23-5
CAS Name: 4,6-dichloro-2,3-dihydro-1H-indole hydrochloride
OPENEYE Name: 4,6-dichloroindoline hydrochloride
IUPAC Name: 4,6-dichloro-2,3-dihydro-1H-indole hydrochloride
SYSTEMATIC NAME: 4,6-bis(chloranyl)-2,3-dihydro-1H-indole hydrochloride
MOLECULAR FORMULA: C8H8Cl3N
MOLECULAR WEIGHT: 224.51482
SMILES: C1CNC2=CC(=CC(=C21)Cl)Cl.Cl
CAS RN: 724788-70-9
CAS Name: 8-bromo-7-fluoro-2-methoxy-1,5-naphthyridine
OPENEYE Name: 8-bromo-7-fluoro-2-methoxy-1,5-naphthyridine
IUPAC Name: 8-bromo-7-fluoro-2-methoxy-1,5-naphthyridine
SYSTEMATIC NAME: 8-bromanyl-7-fluoranyl-2-methoxy-1,5-naphthyridine
MOLECULAR FORMULA: C9H6BrFN2O
MOLECULAR WEIGHT: 257.059143
SMILES: COC1=NC2=C(C(=CN=C2C=C1)F)Br
CAS RN: 1083180-00-0
CAS Name: 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)thiazole
OPENEYE Name: 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)thiazole
IUPAC Name: 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3-thiazole
SYSTEMATIC NAME: 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3-thiazole
MOLECULAR FORMULA: C9H14BNO2S
MOLECULAR WEIGHT: 211.08896
SMILES: B1(OC(C(O1)(C)C)(C)C)C2=CSC=N2
CAS RN: 1016642-07-1
CAS Name: 4-thiazolylboronic acid
OPENEYE Name: thiazol-4-ylboronic acid
IUPAC Name: 1,3-thiazol-4-ylboronic acid
SYSTEMATIC NAME: 1,3-thiazol-4-ylboronic acid
MOLECULAR FORMULA: C3H4BNO2S
MOLECULAR WEIGHT: 128.94536
SMILES: B(C1=CSC=N1)(O)O
CAS RN: 167951-45-3
CAS Name: 4-isocyanato-N-methylbenzenesulfonamide
OPENEYE Name: 4-isocyanato-N-methyl-benzenesulfonamide
IUPAC Name: 4-isocyanato-N-methylbenzenesulfonamide
SYSTEMATIC NAME: 4-isocyanato-N-methyl-benzenesulfonamide
MOLECULAR FORMULA: C8H8N2O3S
MOLECULAR WEIGHT: 212.22572
SMILES: CNS(=O)(=O)C1=CC=C(C=C1)N=C=O
CAS RN: 864774-67-4
CAS Name: 5-bromo-3-ethyl-2H-indazole
OPENEYE Name: 5-bromo-3-ethyl-2H-indazole
IUPAC Name: 5-bromo-3-ethyl-2H-indazole
SYSTEMATIC NAME: 5-bromanyl-3-ethyl-2H-indazole
MOLECULAR FORMULA: C9H9BrN2
MOLECULAR WEIGHT: 225.08516
SMILES: CCC1=C2C=C(C=CC2=NN1)Br
CAS RN: 1016241-84-1
CAS Name: 2-fluoro-5H-pyrrolo[2,3-b]pyrazine-6-carboxylic acid
OPENEYE Name: 2-fluoro-5H-pyrrolo[2,3-b]pyrazine-6-carboxylic acid
IUPAC Name: 2-fluoro-5H-pyrrolo[2,3-b]pyrazine-6-carboxylic acid
SYSTEMATIC NAME: 2-fluoranyl-5H-pyrrolo[2,3-b]pyrazine-6-carboxylic acid
MOLECULAR FORMULA: C7H4FN3O2
MOLECULAR WEIGHT: 181.123963
SMILES: C1=C(NC2=NC=C(N=C21)F)C(=O)O
CAS RN: 814918-95-1
CAS Name: 5-bromo-4-chlorothieno[2,3-d]pyrimidine
OPENEYE Name: 5-bromo-4-chloro-thieno[2,3-d]pyrimidine
IUPAC Name: 5-bromo-4-chlorothieno[2,3-d]pyrimidine
SYSTEMATIC NAME: 5-bromanyl-4-chloranyl-thieno[2,3-d]pyrimidine
MOLECULAR FORMULA: C6H2BrClN2S
MOLECULAR WEIGHT: 249.51548
SMILES: C1=C(C2=C(S1)N=CN=C2Cl)Br
CAS RN: 920978-94-5
CAS Name: 5-fluoro-1H-pyrrolo[2,3-b]pyridine-2-carboxylic acid
OPENEYE Name: 5-fluoro-1H-pyrrolo[2,3-b]pyridine-2-carboxylic acid
IUPAC Name: 5-fluoro-1H-pyrrolo[2,3-b]pyridine-2-carboxylic acid
SYSTEMATIC NAME: 5-fluoranyl-1H-pyrrolo[2,3-b]pyridine-2-carboxylic acid
MOLECULAR FORMULA: C8H5FN2O2
MOLECULAR WEIGHT: 180.135903
SMILES: C1=C2C=C(NC2=NC=C1F)C(=O)O
CAS RN: 932702-35-7
CAS Name: 6-chloro-3-isothiazolo[5,4-b]pyridinecarboxylic acid
OPENEYE Name: 6-chloroisothiazolo[5,4-b]pyridine-3-carboxylic acid
IUPAC Name: 6-chloro-[1,2]thiazolo[5,4-b]pyridine-3-carboxylic acid
SYSTEMATIC NAME: 6-chloranyl-[1,2]thiazolo[5,4-b]pyridine-3-carboxylic acid
MOLECULAR FORMULA: C7H3ClN2O2S
MOLECULAR WEIGHT: 214.62892
SMILES: C1=CC(=NC2=C1C(=NS2)C(=O)O)Cl
CAS RN: 956716-93-1
CAS Name: 1-(4-methylphenyl)sulfonyl-3-pyrrolo[2,3-b]pyridinecarboxaldehyde
OPENEYE Name: 1-(p-tolylsulfonyl)pyrrolo[2,3-b]pyridine-3-carbaldehyde
IUPAC Name: 1-(4-methylphenyl)sulfonylpyrrolo[2,3-b]pyridine-3-carbaldehyde
SYSTEMATIC NAME: 1-(4-methylphenyl)sulfonylpyrrolo[2,3-b]pyridine-3-carbaldehyde
MOLECULAR FORMULA: C15H12N2O3S
MOLECULAR WEIGHT: 300.33238
SMILES: CC1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=C2N=CC=C3)C=O
CAS RN: 90674-84-3
CAS Name: 5-bromo-3-(1-piperidinyl)-2-pyrazinamine
OPENEYE Name: 5-bromo-3-(1-piperidyl)pyrazin-2-amine
IUPAC Name: 5-bromo-3-piperidin-1-ylpyrazin-2-amine
SYSTEMATIC NAME: 5-bromanyl-3-piperidin-1-yl-pyrazin-2-amine
MOLECULAR FORMULA: C9H13BrN4
MOLECULAR WEIGHT: 257.13032
SMILES: C1CCN(CC1)C2=NC(=CN=C2N)Br
CAS RN: 912773-12-7
CAS Name: 3-(1-pyrrolidinyl)-2-pyrazinamine
OPENEYE Name: 3-pyrrolidin-1-ylpyrazin-2-amine
IUPAC Name: 3-pyrrolidin-1-ylpyrazin-2-amine
SYSTEMATIC NAME: 3-pyrrolidin-1-ylpyrazin-2-amine
MOLECULAR FORMULA: C8H12N4
MOLECULAR WEIGHT: 164.20768
SMILES: C1CCN(C1)C2=NC=CN=C2N
CAS RN: 446286-94-8
CAS Name: 5-bromo-N,N-dimethyl-2-pyrazinamine
OPENEYE Name: 5-bromo-N,N-dimethyl-pyrazin-2-amine
IUPAC Name: 5-bromo-N,N-dimethylpyrazin-2-amine
SYSTEMATIC NAME: 5-bromanyl-N,N-dimethyl-pyrazin-2-amine
MOLECULAR FORMULA: C6H8BrN3
MOLECULAR WEIGHT: 202.05182
SMILES: CN(C)C1=CN=C(C=N1)Br
CAS RN: 446286-92-6
CAS Name: 5-bromo-N-methyl-2-pyrazinamine
OPENEYE Name: 5-bromo-N-methyl-pyrazin-2-amine
IUPAC Name: 5-bromo-N-methylpyrazin-2-amine
SYSTEMATIC NAME: 5-bromanyl-N-methyl-pyrazin-2-amine
MOLECULAR FORMULA: C5H6BrN3
MOLECULAR WEIGHT: 188.02524
SMILES: CNC1=CN=C(C=N1)Br
CAS RN: 865472-04-4
CAS Name: 7-bromo-1,2,3,4-tetrahydronaphthalen-1-amine hydrochloride
OPENEYE Name: 7-bromotetralin-1-amine hydrochloride
IUPAC Name: 7-bromo-1,2,3,4-tetrahydronaphthalen-1-amine hydrochloride
SYSTEMATIC NAME: 7-bromanyl-1,2,3,4-tetrahydronaphthalen-1-amine hydrochloride
MOLECULAR FORMULA: C10H13BrClN
MOLECULAR WEIGHT: 262.57392
SMILES: C1CC(C2=C(C1)C=CC(=C2)Br)N.Cl
CAS RN: 733757-90-9
CAS Name: 3-cyclopropyl-4,5,6,7-tetrahydro-1H-pyrazolo[3,4-c]pyridine hydrochloride
OPENEYE Name: 3-cyclopropyl-4,5,6,7-tetrahydro-1H-pyrazolo[3,4-c]pyridine hydrochloride
IUPAC Name: 3-cyclopropyl-4,5,6,7-tetrahydro-1H-pyrazolo[3,4-c]pyridine hydrochloride
SYSTEMATIC NAME: 3-cyclopropyl-4,5,6,7-tetrahydro-1H-pyrazolo[3,4-c]pyridine hydrochloride
MOLECULAR FORMULA: C9H14ClN3
MOLECULAR WEIGHT: 199.68056
SMILES: C1CC1C2=NNC3=C2CCNC3.Cl
CAS RN: 853784-21-1
CAS Name: 3-(trifluoromethyl)-4,5,6,7-tetrahydro-1H-pyrazolo[3,4-c]pyridine
OPENEYE Name: 3-(trifluoromethyl)-4,5,6,7-tetrahydro-1H-pyrazolo[3,4-c]pyridine
IUPAC Name: 3-(trifluoromethyl)-4,5,6,7-tetrahydro-1H-pyrazolo[3,4-c]pyridine
SYSTEMATIC NAME: 3-(trifluoromethyl)-4,5,6,7-tetrahydro-1H-pyrazolo[3,4-c]pyridine
MOLECULAR FORMULA: C7H8F3N3
MOLECULAR WEIGHT: 191.15373
SMILES: C1CNCC2=C1C(=NN2)C(F)(F)F
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