CAS RN: 40615-39-2
CAS Name: 1-[5-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]-4-hydroxy-2-oxolanyl]-5-methylpyrimidine-2,4-dione
OPENEYE Name: 1-[5-[[bis(4-methoxyphenyl)-phenyl-methoxy]methyl]-4-hydroxy-tetrahydrofuran-2-yl]-5-methyl-pyrimidine-2,4-dione
IUPAC Name: 1-[5-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]-4-hydroxyoxolan-2-yl]-5-methylpyrimidine-2,4-dione
SYSTEMATIC NAME: 1-[5-[[bis(4-methoxyphenyl)-phenyl-methoxy]methyl]-4-oxidanyl-oxolan-2-yl]-5-methyl-pyrimidine-2,4-dione
MOLECULAR FORMULA: C31H32N2O7
MOLECULAR WEIGHT: 544.59498
SMILES: CC1=CN(C(=O)NC1=O)C2CC(C(O2)COC(C3=CC=CC=C3)(C4=CC=C(C=C4)OC)C5=CC=C(C=C5)OC)O
Structure:
CAS RN: 84852-40-4
CAS Name: 1,2-dihydrocoronene
OPENEYE Name: 1,2-dihydrocoronene
IUPAC Name: 1,2-dihydrocoronene
SYSTEMATIC NAME: 1,2-dihydrocoronene
MOLECULAR FORMULA: C24H14
MOLECULAR WEIGHT: 302.36796
SMILES: C1CC2=C3C4=C1C=CC5=C4C6=C(C=C5)C=CC7=C6C3=C(C=C2)C=C7
Structure:
CAS RN: 63059-29-0
CAS Name: 2-iodobenzenesulfonyl chloride
OPENEYE Name: 2-iodobenzenesulfonyl chloride
IUPAC Name: 2-iodobenzenesulfonyl chloride
SYSTEMATIC NAME: 2-iodanylbenzenesulfonyl chloride
MOLECULAR FORMULA: C6H4ClIO2S
MOLECULAR WEIGHT: 302.51723
SMILES: C1=CC=C(C(=C1)S(=O)(=O)Cl)I
Structure:
CAS RN: 42189-56-0
CAS Name: 1-(1-pyrenyl)pyrrole-2,5-dione
OPENEYE Name: 1-pyren-1-ylpyrrole-2,5-dione
IUPAC Name: 1-pyren-1-ylpyrrole-2,5-dione
SYSTEMATIC NAME: 1-pyren-1-ylpyrrole-2,5-dione
MOLECULAR FORMULA: C20H11NO2
MOLECULAR WEIGHT: 297.30684
SMILES: C1=CC2=C3C(=C1)C=CC4=C(C=CC(=C43)C=C2)N5C(=O)C=CC5=O
Structure:
CAS RN: 200004-38-2
CAS Name: 1-[bromo-bis(4-fluorophenyl)methyl]-4-fluorobenzene
OPENEYE Name: 1-[bromo-bis(4-fluorophenyl)methyl]-4-fluoro-benzene
IUPAC Name: 1-[bromo-bis(4-fluorophenyl)methyl]-4-fluorobenzene
SYSTEMATIC NAME: 1-[bromanyl-bis(4-fluorophenyl)methyl]-4-fluoranyl-benzene
MOLECULAR FORMULA: C19H12BrF3
MOLECULAR WEIGHT: 377.19779
SMILES: C1=CC(=CC=C1C(C2=CC=C(C=C2)F)(C3=CC=C(C=C3)F)Br)F
Structure:
CAS RN: 106515-42-8
CAS Name: 1-(1,3-benzothiazol-2-yl)-3,4-dimethyl-6-pyrano[2,3-c]pyrazolone
OPENEYE Name: 1-(1,3-benzothiazol-2-yl)-3,4-dimethyl-pyrano[2,3-c]pyrazol-6-one
IUPAC Name: 1-(1,3-benzothiazol-2-yl)-3,4-dimethylpyrano[2,3-c]pyrazol-6-one
SYSTEMATIC NAME: 1-(1,3-benzothiazol-2-yl)-3,4-dimethyl-pyrano[2,3-c]pyrazol-6-one
MOLECULAR FORMULA: C15H11N3O2S
MOLECULAR WEIGHT: 297.33174
SMILES: CC1=CC(=O)OC2=C1C(=NN2C3=NC4=CC=CC=C4S3)C
Structure:
CAS RN: 17823-46-0
CAS Name: 1-bromo-2,3,5,6-tetrafluoro-4-(trifluoromethyl)benzene
OPENEYE Name: 1-bromo-2,3,5,6-tetrafluoro-4-(trifluoromethyl)benzene
IUPAC Name: 1-bromo-2,3,5,6-tetrafluoro-4-(trifluoromethyl)benzene
SYSTEMATIC NAME: 1-bromanyl-2,3,5,6-tetrakis(fluoranyl)-4-(trifluoromethyl)benzene
MOLECULAR FORMULA: C7BrF7
MOLECULAR WEIGHT: 296.967722
SMILES: C1(=C(C(=C(C(=C1F)F)Br)F)F)C(F)(F)F
Structure:
CAS RN: 71838-16-9
CAS Name: 2-bromo-1-iodo-4-methylbenzene
OPENEYE Name: 2-bromo-1-iodo-4-methyl-benzene
IUPAC Name: 2-bromo-1-iodo-4-methylbenzene
SYSTEMATIC NAME: 2-bromanyl-1-iodanyl-4-methyl-benzene
MOLECULAR FORMULA: C7H6BrI
MOLECULAR WEIGHT: 296.93101
SMILES: CC1=CC(=C(C=C1)I)Br
Structure:
CAS RN: 66750-10-5
CAS Name: 13-phenyl-1,4,7,10-tetraoxa-13-azacyclopentadecane
OPENEYE Name: 13-phenyl-1,4,7,10-tetraoxa-13-azacyclopentadecane
IUPAC Name: 13-phenyl-1,4,7,10-tetraoxa-13-azacyclopentadecane
SYSTEMATIC NAME: 13-phenyl-1,4,7,10-tetraoxa-13-azacyclopentadecane
MOLECULAR FORMULA: C16H25NO4
MOLECULAR WEIGHT: 295.374
SMILES: C1COCCOCCOCCOCCN1C2=CC=CC=C2
Structure:
CAS RN: 76286-84-5
CAS Name: 4,6-dimethyl-7-phenylpurino[7,8-a]imidazole-1,3-dione
OPENEYE Name: 4,6-dimethyl-7-phenyl-purino[7,8-a]imidazole-1,3-dione
IUPAC Name: 4,6-dimethyl-7-phenylpurino[7,8-a]imidazole-1,3-dione
SYSTEMATIC NAME: 4,6-dimethyl-7-phenyl-purino[7,8-a]imidazole-1,3-dione
MOLECULAR FORMULA: C15H13N5O2
MOLECULAR WEIGHT: 295.29602
SMILES: CN1C(=CN2C1=NC3=C2C(=O)NC(=O)N3C)C4=CC=CC=C4
Structure:
CAS RN: 5220-00-8
CAS Name: 5-[2-(ethylthio)propyl]-2-[1-(1-pyrrolidinyl)butylidene]cyclohexane-1,3-dione
OPENEYE Name: 5-(2-ethylsulfanylpropyl)-2-(1-pyrrolidin-1-ylbutylidene)cyclohexane-1,3-dione
IUPAC Name: 5-(2-ethylsulfanylpropyl)-2-(1-pyrrolidin-1-ylbutylidene)cyclohexane-1,3-dione
SYSTEMATIC NAME: 5-(2-ethylsulfanylpropyl)-2-(1-pyrrolidin-1-ylbutylidene)cyclohexane-1,3-dione
MOLECULAR FORMULA: C19H31NO2S
MOLECULAR WEIGHT: 337.51994
SMILES: CCCC(=C1C(=O)CC(CC1=O)CC(C)SCC)N2CCCC2
Structure:
CAS RN: 948292-48-6
CAS Name: 3-(4-bromophenyl)-1H-pyrazole-5-carboxylic acid ethyl ester
OPENEYE Name: ethyl 3-(4-bromophenyl)-1H-pyrazole-5-carboxylate
IUPAC Name: ethyl 3-(4-bromophenyl)-1H-pyrazole-5-carboxylate
SYSTEMATIC NAME: ethyl 3-(4-bromophenyl)-1H-pyrazole-5-carboxylate
MOLECULAR FORMULA: C12H11BrN2O2
MOLECULAR WEIGHT: 295.13194
SMILES: CCOC(=O)C1=CC(=NN1)C2=CC=C(C=C2)Br
Structure:
CAS RN: 15155-41-6
CAS Name: 4,7-dibromo-2,1,3-benzothiadiazole
OPENEYE Name: 4,7-dibromo-2,1,3-benzothiadiazole
IUPAC Name: 4,7-dibromo-2,1,3-benzothiadiazole
SYSTEMATIC NAME: 4,7-bis(bromanyl)-2,1,3-benzothiadiazole
MOLECULAR FORMULA: C6H2Br2N2S
MOLECULAR WEIGHT: 293.96648
SMILES: C1=C(C2=NSN=C2C(=C1)Br)Br
Structure:
CAS RN: 100849-52-3
CAS Name: 5-ethyl-1-[(methylthio)methyl]-5-phenyl-1,3-diazinane-2,4,6-trione
OPENEYE Name: 5-ethyl-1-(methylsulfanylmethyl)-5-phenyl-hexahydropyrimidine-2,4,6-trione
IUPAC Name: 5-ethyl-1-(methylsulfanylmethyl)-5-phenyl-1,3-diazinane-2,4,6-trione
SYSTEMATIC NAME: 5-ethyl-1-(methylsulfanylmethyl)-5-phenyl-1,3-diazinane-2,4,6-trione
MOLECULAR FORMULA: C14H16N2O3S
MOLECULAR WEIGHT: 292.35344
SMILES: CCC1(C(=O)NC(=O)N(C1=O)CSC)C2=CC=CC=C2
Structure:
CAS RN: 13403-01-5
CAS Name: 2-[2,4-bis(2-methylbutan-2-yl)phenoxy]butanoic acid
OPENEYE Name: 2-[2,4-bis(1,1-dimethylpropyl)phenoxy]butanoic acid
IUPAC Name: 2-[2,4-bis(2-methylbutan-2-yl)phenoxy]butanoic acid
SYSTEMATIC NAME: 2-[2,4-bis(2-methylbutan-2-yl)phenoxy]butanoic acid
MOLECULAR FORMULA: C20H32O3
MOLECULAR WEIGHT: 320.46628
SMILES: CCC(C(=O)O)OC1=C(C=C(C=C1)C(C)(C)CC)C(C)(C)CC
Structure:
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