CAS RN: 130-22-3
CAS Name: sodium 3,4-dihydroxy-9,10-dioxo-2-anthracenesulfonate
OPENEYE Name: sodium 3,4-dihydroxy-9,10-dioxo-anthracene-2-sulfonate
IUPAC Name: sodium 3,4-dihydroxy-9,10-dioxoanthracene-2-sulfonate
SYSTEMATIC NAME: sodium 3,4-bis(oxidanyl)-9,10-bis(oxidanylidene)anthracene-2-sulfonate
MOLECULAR FORMULA: C14H7NaO7S
MOLECULAR WEIGHT: 342.25595
SMILES: C1=CC=C2C(=C1)C(=O)C3=CC(=C(C(=C3C2=O)O)O)S(=O)(=O)[O-].[Na+]
Structure:
CAS RN: 12777-35-4
CAS Name: sodium 3,4-dihydroxy-9,10-dioxo-2-anthracenesulfonate
OPENEYE Name: sodium 3,4-dihydroxy-9,10-dioxo-anthracene-2-sulfonate
IUPAC Name: sodium 3,4-dihydroxy-9,10-dioxoanthracene-2-sulfonate
SYSTEMATIC NAME: sodium 3,4-bis(oxidanyl)-9,10-bis(oxidanylidene)anthracene-2-sulfonate
MOLECULAR FORMULA: C14H7NaO7S
MOLECULAR WEIGHT: 342.25595
SMILES: C1=CC=C2C(=C1)C(=O)C3=CC(=C(C(=C3C2=O)O)O)S(=O)(=O)[O-].[Na+]
Structure:
CAS RN: 63309-95-5
CAS Name: sodium 3,4-dihydroxy-9,10-dioxo-2-anthracenesulfonate
OPENEYE Name: sodium 3,4-dihydroxy-9,10-dioxo-anthracene-2-sulfonate
IUPAC Name: sodium 3,4-dihydroxy-9,10-dioxoanthracene-2-sulfonate
SYSTEMATIC NAME: sodium 3,4-bis(oxidanyl)-9,10-bis(oxidanylidene)anthracene-2-sulfonate
MOLECULAR FORMULA: C14H7NaO7S
MOLECULAR WEIGHT: 342.25595
SMILES: C1=CC=C2C(=C1)C(=O)C3=CC(=C(C(=C3C2=O)O)O)S(=O)(=O)[O-].[Na+]
Structure:
CAS RN: 6578-07-0
CAS Name: (5-bromo-4-chloro-1H-indol-3-yl) sulfate
OPENEYE Name: (5-bromo-4-chloro-1H-indol-3-yl) sulfate
IUPAC Name: (5-bromo-4-chloro-1H-indol-3-yl) sulfate
SYSTEMATIC NAME: (5-bromanyl-4-chloranyl-1H-indol-3-yl) sulfate
MOLECULAR FORMULA: C8H4BrClNO4S-
MOLECULAR WEIGHT: 325.54366
SMILES: C1=CC(=C(C2=C1NC=C2OS(=O)(=O)[O-])Cl)Br
Structure:
CAS RN: 5765-48-0
CAS Name: 4-(2-ethyl-5-isoxazol-2-iumyl)benzenesulfonate
OPENEYE Name: 4-(2-ethylisoxazol-2-ium-5-yl)benzenesulfonate
IUPAC Name: 4-(2-ethyl-1,2-oxazol-2-ium-5-yl)benzenesulfonate
SYSTEMATIC NAME: 4-(2-ethyl-1,2-oxazol-2-ium-5-yl)benzenesulfonate
MOLECULAR FORMULA: C11H11NO4S
MOLECULAR WEIGHT: 253.27434
SMILES: CC[N+]1=CC=C(O1)C2=CC=C(C=C2)S(=O)(=O)[O-]
Structure:
CAS RN: 63712-45-8
CAS Name: 1-(3-chlorophenyl)-3-(2,4-dinitroanilino)urea
OPENEYE Name: 1-(3-chlorophenyl)-3-(2,4-dinitroanilino)urea
IUPAC Name: 1-(3-chlorophenyl)-3-(2,4-dinitroanilino)urea
SYSTEMATIC NAME: 1-(3-chlorophenyl)-3-[(2,4-dinitrophenyl)amino]urea
MOLECULAR FORMULA: C13H10ClN5O5
MOLECULAR WEIGHT: 351.702
SMILES: C1=CC(=CC(=C1)Cl)NC(=O)NNC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]
Structure:
CAS RN: 3438-81-1
CAS Name: 7-(3-methylbutylthio)-5,6-dihydroimidazo[4,5-d]pyridazine-4-thione
OPENEYE Name: 7-isopentylsulfanyl-5,6-dihydroimidazo[4,5-d]pyridazine-4-thione
IUPAC Name: 7-(3-methylbutylsulfanyl)-5,6-dihydroimidazo[4,5-d]pyridazine-4-thione
SYSTEMATIC NAME: 7-(3-methylbutylsulfanyl)-5,6-dihydroimidazo[4,5-d]pyridazine-4-thione
MOLECULAR FORMULA: C10H14N4S2
MOLECULAR WEIGHT: 254.37496
SMILES: CC(C)CCSC1=C2C(=NC=N2)C(=S)NN1
Structure:
CAS RN: 7234-71-1
CAS Name: [1,2-bis(dimethylamino)-2-dimethyliminioethylidene]-dimethylammonium
OPENEYE Name: [1,2-bis(dimethylamino)-2-dimethyliminio-ethylidene]-dimethyl-ammonium
IUPAC Name: [1,2-bis(dimethylamino)-2-dimethylazaniumylideneethylidene]-dimethylazanium
SYSTEMATIC NAME: [1,2-bis(dimethylamino)-2-dimethylazaniumylidene-ethylidene]-dimethyl-azanium
MOLECULAR FORMULA: C10H24N4+2
MOLECULAR WEIGHT: 200.32436
SMILES: CN(C)C(=[N+](C)C)C(=[N+](C)C)N(C)C
Structure:
CAS RN: 15870-62-9
CAS Name: 8-[(3-aminophenyl)methylthio]-3,7-dihydropurin-6-one
OPENEYE Name: 8-[(3-aminophenyl)methylsulfanyl]-3,7-dihydropurin-6-one
IUPAC Name: 8-[(3-aminophenyl)methylsulfanyl]-3,7-dihydropurin-6-one
SYSTEMATIC NAME: 8-[(3-aminophenyl)methylsulfanyl]-3,7-dihydropurin-6-one
MOLECULAR FORMULA: C12H11N5OS
MOLECULAR WEIGHT: 273.31364
SMILES: C1=CC(=CC(=C1)N)CSC2=NC3=C(N2)C(=O)N=CN3
Structure:
CAS RN: 13957-31-8
CAS Name: 1-[3,4-dihydroxy-5-(hydroxymethyl)-2-oxolanyl]-4-sulfanylidene-2-pyrimidinone
OPENEYE Name: 1-[3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-4-thioxo-pyrimidin-2-one
IUPAC Name: 1-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-4-sulfanylidenepyrimidin-2-one
SYSTEMATIC NAME: 1-[5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]-4-sulfanylidene-pyrimidin-2-one
MOLECULAR FORMULA: C9H12N2O5S
MOLECULAR WEIGHT: 260.26698
SMILES: C1=CN(C(=O)NC1=S)C2C(C(C(O2)CO)O)O
Structure:
CAS RN: 32754-06-6
CAS Name: 1-[3,4-dihydroxy-5-(hydroxymethyl)-2-oxolanyl]-4-sulfanylidene-2-pyrimidinone
OPENEYE Name: 1-[3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-4-thioxo-pyrimidin-2-one
IUPAC Name: 1-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-4-sulfanylidenepyrimidin-2-one
SYSTEMATIC NAME: 1-[5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]-4-sulfanylidene-pyrimidin-2-one
MOLECULAR FORMULA: C9H12N2O5S
MOLECULAR WEIGHT: 260.26698
SMILES: C1=CN(C(=O)NC1=S)C2C(C(C(O2)CO)O)O
Structure:
CAS RN: 37436-97-8
CAS Name: (5-hydrazinyl-1H-imidazo[4,5-b]pyridin-7-yl)hydrazine
OPENEYE Name: (5-hydrazino-1H-imidazo[4,5-b]pyridin-7-yl)hydrazine
IUPAC Name: (5-hydrazinyl-1H-imidazo[4,5-b]pyridin-7-yl)hydrazine
SYSTEMATIC NAME: (5-diazanyl-1H-imidazo[4,5-b]pyridin-7-yl)diazane
MOLECULAR FORMULA: C6H9N7
MOLECULAR WEIGHT: 179.18256
SMILES: C1=C(C2=C(N=CN2)N=C1NN)NN
Structure:
CAS RN: 41657-72-1
CAS Name: (4-azidophenyl)-phenyldiazene
OPENEYE Name: (4-azidophenyl)-phenyl-diazene
IUPAC Name: (4-azidophenyl)-phenyldiazene
SYSTEMATIC NAME: (4-azidophenyl)-phenyl-diazene
MOLECULAR FORMULA: C12H9N5
MOLECULAR WEIGHT: 223.23336
SMILES: C1=CC=C(C=C1)N=NC2=CC=C(C=C2)N=[N+]=[N-]
Structure:
CAS RN: 79797-45-8
CAS Name: 1-[1,2-bis(4-methoxyphenyl)butyl]-3-(4-methylphenyl)thiourea
OPENEYE Name: 1-[1,2-bis(4-methoxyphenyl)butyl]-3-(p-tolyl)thiourea
IUPAC Name: 1-[1,2-bis(4-methoxyphenyl)butyl]-3-(4-methylphenyl)thiourea
SYSTEMATIC NAME: 1-[1,2-bis(4-methoxyphenyl)butyl]-3-(4-methylphenyl)thiourea
MOLECULAR FORMULA: C26H30N2O2S
MOLECULAR WEIGHT: 434.5936
SMILES: CCC(C1=CC=C(C=C1)OC)C(C2=CC=C(C=C2)OC)NC(=S)NC3=CC=C(C=C3)C
Structure:
CAS RN: 18684-24-7
CAS Name: 4-hydroxy-1-[oxo(2-pyrrolidinyl)methyl]-2-pyrrolidinecarboxylic acid
OPENEYE Name: 4-hydroxy-1-(pyrrolidine-2-carbonyl)pyrrolidine-2-carboxylic acid
IUPAC Name: 4-hydroxy-1-(pyrrolidine-2-carbonyl)pyrrolidine-2-carboxylic acid
SYSTEMATIC NAME: 4-oxidanyl-1-pyrrolidin-2-ylcarbonyl-pyrrolidine-2-carboxylic acid
MOLECULAR FORMULA: C10H16N2O4
MOLECULAR WEIGHT: 228.24504
SMILES: C1CC(NC1)C(=O)N2CC(CC2C(=O)O)O
Structure:
CAS RN: 59440-82-3
CAS Name: 1-phenyl-3-[4-[(2-phenyl-3-pyrazolyl)sulfamoyl]phenyl]thiourea
OPENEYE Name: 1-phenyl-3-[4-[(2-phenylpyrazol-3-yl)sulfamoyl]phenyl]thiourea
IUPAC Name: 1-phenyl-3-[4-[(2-phenylpyrazol-3-yl)sulfamoyl]phenyl]thiourea
SYSTEMATIC NAME: 1-phenyl-3-[4-[(2-phenylpyrazol-3-yl)sulfamoyl]phenyl]thiourea
MOLECULAR FORMULA: C22H19N5O2S2
MOLECULAR WEIGHT: 449.54856
SMILES: C1=CC=C(C=C1)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC3=CC=NN3C4=CC=CC=C4
Structure:
CAS RN: 6310-80-1
CAS Name: 3-azido-9H-carbazole
OPENEYE Name: 3-azido-9H-carbazole
IUPAC Name: 3-azido-9H-carbazole
SYSTEMATIC NAME: 3-azido-9H-carbazole
MOLECULAR FORMULA: C12H8N4
MOLECULAR WEIGHT: 208.21872
SMILES: C1=CC=C2C(=C1)C3=C(N2)C=CC(=C3)N=[N+]=[N-]
Structure:
CAS RN: 70472-39-8
CAS Name: 1-(benzenesulfonyl)-3-(4-chlorophenyl)thiourea
OPENEYE Name: 1-(benzenesulfonyl)-3-(4-chlorophenyl)thiourea
IUPAC Name: 1-(benzenesulfonyl)-3-(4-chlorophenyl)thiourea
SYSTEMATIC NAME: 1-(4-chlorophenyl)-3-(phenylsulfonyl)thiourea
MOLECULAR FORMULA: C13H11ClN2O2S2
MOLECULAR WEIGHT: 326.82164
SMILES: C1=CC=C(C=C1)S(=O)(=O)NC(=S)NC2=CC=C(C=C2)Cl
Structure:
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