CAS RN: 6265-23-2
CAS Name: 2-(1-naphthalenyl)-4-quinolinecarboxylate
OPENEYE Name: 2-(1-naphthyl)quinoline-4-carboxylate
IUPAC Name: 2-naphthalen-1-ylquinoline-4-carboxylate
SYSTEMATIC NAME: 2-naphthalen-1-ylquinoline-4-carboxylate
MOLECULAR FORMULA: C20H12NO2-
MOLECULAR WEIGHT: 298.31478
SMILES: C1=CC=C2C(=C1)C=CC=C2C3=NC4=CC=CC=C4C(=C3)C(=O)[O-]
Structure:
CAS RN: 17057-07-7
CAS Name: 3-(2,5-dioxo-1-pyrrolyl)benzoate
OPENEYE Name: 3-(2,5-dioxopyrrol-1-yl)benzoate
IUPAC Name: 3-(2,5-dioxopyrrol-1-yl)benzoate
SYSTEMATIC NAME: 3-[2,5-bis(oxidanylidene)pyrrol-1-yl]benzoate
MOLECULAR FORMULA: C11H6NO4-
MOLECULAR WEIGHT: 216.16964
SMILES: C1=CC(=CC(=C1)N2C(=O)C=CC2=O)C(=O)[O-]
Structure:
CAS RN: 23767-32-0
CAS Name: 2-methylsulfonyl-5-phenyl-1,3,4-oxadiazole
OPENEYE Name: 2-methylsulfonyl-5-phenyl-1,3,4-oxadiazole
IUPAC Name: 2-methylsulfonyl-5-phenyl-1,3,4-oxadiazole
SYSTEMATIC NAME: 2-methylsulfonyl-5-phenyl-1,3,4-oxadiazole
MOLECULAR FORMULA: C9H8N2O3S
MOLECULAR WEIGHT: 224.23642
SMILES: CS(=O)(=O)C1=NN=C(O1)C2=CC=CC=C2
Structure:
CAS RN: 887981-86-4
CAS Name: 6-thiophen-2-yl-2-pyridinecarboxylic acid
OPENEYE Name: 6-(2-thienyl)pyridine-2-carboxylic acid
IUPAC Name: 6-thiophen-2-ylpyridine-2-carboxylic acid
SYSTEMATIC NAME: 6-thiophen-2-ylpyridine-2-carboxylic acid
MOLECULAR FORMULA: C10H7NO2S
MOLECULAR WEIGHT: 205.23308
SMILES: C1=CC(=NC(=C1)C(=O)O)C2=CC=CS2
Structure:
CAS RN: 3846-12-6
CAS Name: 4-imino-5,5-dimethyl-3-phenyl-2-oxazolidinone
OPENEYE Name: 4-imino-5,5-dimethyl-3-phenyl-oxazolidin-2-one
IUPAC Name: 4-imino-5,5-dimethyl-3-phenyl-1,3-oxazolidin-2-one
SYSTEMATIC NAME: 4-azanylidene-5,5-dimethyl-3-phenyl-1,3-oxazolidin-2-one
MOLECULAR FORMULA: C11H12N2O2
MOLECULAR WEIGHT: 204.22518
SMILES: CC1(C(=N)N(C(=O)O1)C2=CC=CC=C2)C
Structure:
CAS RN: 1970-81-6
CAS Name: 5-(3-pyridinyl)-3-pyridinecarboxylic acid
OPENEYE Name: 5-(3-pyridyl)pyridine-3-carboxylic acid
IUPAC Name: 5-pyridin-3-ylpyridine-3-carboxylic acid
SYSTEMATIC NAME: 5-pyridin-3-ylpyridine-3-carboxylic acid
MOLECULAR FORMULA: C11H8N2O2
MOLECULAR WEIGHT: 200.19342
SMILES: C1=CC(=CN=C1)C2=CC(=CN=C2)C(=O)O
Structure:
CAS RN: 14001-67-3
CAS Name: 5-bromo-2-(methylthio)pyrimidine
OPENEYE Name: 5-bromo-2-methylsulfanyl-pyrimidine
IUPAC Name: 5-bromo-2-methylsulfanylpyrimidine
SYSTEMATIC NAME: 5-bromanyl-2-methylsulfanyl-pyrimidine
MOLECULAR FORMULA: C5H5BrN2S
MOLECULAR WEIGHT: 205.0756
SMILES: CSC1=NC=C(C=N1)Br
Structure:
CAS RN: 115310-16-2
CAS Name: 1-(phenylmethyl)-6,7-dihydro-5H-indazol-4-one
OPENEYE Name: 1-benzyl-6,7-dihydro-5H-indazol-4-one
IUPAC Name: 1-benzyl-6,7-dihydro-5H-indazol-4-one
SYSTEMATIC NAME: 1-(phenylmethyl)-6,7-dihydro-5H-indazol-4-one
MOLECULAR FORMULA: C14H14N2O
MOLECULAR WEIGHT: 226.27376
SMILES: C1CC2=C(C=NN2CC3=CC=CC=C3)C(=O)C1
Structure:
CAS RN: 14823-31-5
CAS Name: 1-phenyl-6,7-dihydro-5H-indazol-4-one
OPENEYE Name: 1-phenyl-6,7-dihydro-5H-indazol-4-one
IUPAC Name: 1-phenyl-6,7-dihydro-5H-indazol-4-one
SYSTEMATIC NAME: 1-phenyl-6,7-dihydro-5H-indazol-4-one
MOLECULAR FORMULA: C13H12N2O
MOLECULAR WEIGHT: 212.24718
SMILES: C1CC2=C(C=NN2C3=CC=CC=C3)C(=O)C1
Structure:
CAS RN: 32399-13-6
CAS Name: 2-(methylamino)-3-pyridinecarboxylic acid
OPENEYE Name: 2-(methylamino)pyridine-3-carboxylic acid
IUPAC Name: 2-(methylamino)pyridine-3-carboxylic acid
SYSTEMATIC NAME: 2-(methylamino)pyridine-3-carboxylic acid
MOLECULAR FORMULA: C7H8N2O2
MOLECULAR WEIGHT: 152.15062
SMILES: CNC1=C(C=CC=N1)C(=O)O
Structure:
CAS RN: 288151-49-5
CAS Name: 6-fluoro-2-methyl-4-quinolinamine
OPENEYE Name: 6-fluoro-2-methyl-quinolin-4-amine
IUPAC Name: 6-fluoro-2-methylquinolin-4-amine
SYSTEMATIC NAME: 6-fluoranyl-2-methyl-quinolin-4-amine
MOLECULAR FORMULA: C10H9FN2
MOLECULAR WEIGHT: 176.190263
SMILES: CC1=NC2=C(C=C(C=C2)F)C(=C1)N
Structure:
CAS RN: 89488-29-9
CAS Name: 2-bromo-4-methoxypyridine
OPENEYE Name: 2-bromo-4-methoxy-pyridine
IUPAC Name: 2-bromo-4-methoxypyridine
SYSTEMATIC NAME: 2-bromanyl-4-methoxy-pyridine
MOLECULAR FORMULA: C6H6BrNO
MOLECULAR WEIGHT: 188.02194
SMILES: COC1=CC(=NC=C1)Br
Structure:
CAS RN: 89581-53-3
CAS Name: 3,5-dibromo-4-methyl-1H-pyridin-2-one
OPENEYE Name: 3,5-dibromo-4-methyl-1H-pyridin-2-one
IUPAC Name: 3,5-dibromo-4-methyl-1H-pyridin-2-one
SYSTEMATIC NAME: 3,5-bis(bromanyl)-4-methyl-1H-pyridin-2-one
MOLECULAR FORMULA: C6H5Br2NO
MOLECULAR WEIGHT: 266.918
SMILES: CC1=C(C(=O)NC=C1Br)Br
Structure:
CAS RN: 69812-51-7
CAS Name: 4-chlorosulfonylbenzoic acid methyl ester
OPENEYE Name: methyl 4-chlorosulfonylbenzoate
IUPAC Name: methyl 4-chlorosulfonylbenzoate
SYSTEMATIC NAME: methyl 4-chloranylsulfonylbenzoate
MOLECULAR FORMULA: C8H7ClO4S
MOLECULAR WEIGHT: 234.65678
SMILES: COC(=O)C1=CC=C(C=C1)S(=O)(=O)Cl
Structure:
CAS RN: 87001-32-9
CAS Name: 4-phenylmethoxybenzenesulfonyl chloride
OPENEYE Name: 4-benzyloxybenzenesulfonyl chloride
IUPAC Name: 4-phenylmethoxybenzenesulfonyl chloride
SYSTEMATIC NAME: 4-phenylmethoxybenzenesulfonyl chloride
MOLECULAR FORMULA: C13H11ClO3S
MOLECULAR WEIGHT: 282.74264
SMILES: C1=CC=C(C=C1)COC2=CC=C(C=C2)S(=O)(=O)Cl
Structure:
CAS RN: 55317-53-8
CAS Name: 2-(1-pyrazolyl)benzoic acid
OPENEYE Name: 2-pyrazol-1-ylbenzoic acid
IUPAC Name: 2-pyrazol-1-ylbenzoic acid
SYSTEMATIC NAME: 2-pyrazol-1-ylbenzoic acid
MOLECULAR FORMULA: C10H8N2O2
MOLECULAR WEIGHT: 188.18272
SMILES: C1=CC=C(C(=C1)C(=O)O)N2C=CC=N2
Structure:
CAS RN: 1721-23-9
CAS Name: 2-methyl-3-pyridinecarbonitrile
OPENEYE Name: 2-methylpyridine-3-carbonitrile
IUPAC Name: 2-methylpyridine-3-carbonitrile
SYSTEMATIC NAME: 2-methylpyridine-3-carbonitrile
MOLECULAR FORMULA: C7H6N2
MOLECULAR WEIGHT: 118.13594
SMILES: CC1=C(C=CC=N1)C#N
Structure:
CAS RN: 13473-01-3
CAS Name: 5-chloro-2-methoxypyridine
OPENEYE Name: 5-chloro-2-methoxy-pyridine
IUPAC Name: 5-chloro-2-methoxypyridine
SYSTEMATIC NAME: 5-chloranyl-2-methoxy-pyridine
MOLECULAR FORMULA: C6H6ClNO
MOLECULAR WEIGHT: 143.57094
SMILES: COC1=NC=C(C=C1)Cl
Structure:
CAS RN: 73290-22-9
CAS Name: 2-bromo-5-iodopyridine
OPENEYE Name: 2-bromo-5-iodo-pyridine
IUPAC Name: 2-bromo-5-iodopyridine
SYSTEMATIC NAME: 2-bromanyl-5-iodanyl-pyridine
MOLECULAR FORMULA: C5H3BrIN
MOLECULAR WEIGHT: 283.89249
SMILES: C1=CC(=NC=C1I)Br
Structure:
CAS RN: 90558-40-0
CAS Name: 2-(4-methylsulfonyl-2-nitroanilino)acetate
OPENEYE Name: 2-(4-methylsulfonyl-2-nitro-anilino)acetate
IUPAC Name: 2-(4-methylsulfonyl-2-nitroanilino)acetate
SYSTEMATIC NAME: 2-[(4-methylsulfonyl-2-nitro-phenyl)amino]ethanoate
MOLECULAR FORMULA: C9H9N2O6S-
MOLECULAR WEIGHT: 273.24256
SMILES: CS(=O)(=O)C1=CC(=C(C=C1)NCC(=O)[O-])[N+](=O)[O-]
Structure:
CAS RN: 890591-20-5
CAS Name: 3-(4-bromophenyl)-1H-pyrazole-5-carboxylic acid
OPENEYE Name: 3-(4-bromophenyl)-1H-pyrazole-5-carboxylic acid
IUPAC Name: 3-(4-bromophenyl)-1H-pyrazole-5-carboxylic acid
SYSTEMATIC NAME: 3-(4-bromophenyl)-1H-pyrazole-5-carboxylic acid
MOLECULAR FORMULA: C10H7BrN2O2
MOLECULAR WEIGHT: 267.07878
SMILES: C1=CC(=CC=C1C2=NNC(=C2)C(=O)O)Br
Structure:
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