CAS RN: 136281-52-2
CAS Name: N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]-5-ethyl-8-oxo-[1,3]dioxolo[4,5-g]quinoline-7-carboxamide
OPENEYE Name: 5-ethyl-N-[2-hydroxy-1,1-bis(hydroxymethyl)ethyl]-8-oxo-[1,3]dioxolo[4,5-g]quinoline-7-carboxamide
IUPAC Name: N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]-5-ethyl-8-oxo-[1,3]dioxolo[4,5-g]quinoline-7-carboxamide
SYSTEMATIC NAME: 5-ethyl-N-[2-(hydroxymethyl)-1,3-bis(oxidanyl)propan-2-yl]-8-oxidanylidene-[1,3]dioxolo[4,5-g]quinoline-7-carboxamide
MOLECULAR FORMULA: C17H20N2O7
MOLECULAR WEIGHT: 364.3499
SMILES: CCN1C=C(C(=O)C2=CC3=C(C=C21)OCO3)C(=O)NC(CO)(CO)CO
Structure:
CAS RN: 136265-52-6
CAS Name: 2-chloro-1-(3-thietanyl)benzimidazole
OPENEYE Name: 2-chloro-1-(thietan-3-yl)benzimidazole
IUPAC Name: 2-chloro-1-(thietan-3-yl)benzimidazole
SYSTEMATIC NAME: 2-chloranyl-1-(thietan-3-yl)benzimidazole
MOLECULAR FORMULA: C10H9ClN2S
MOLECULAR WEIGHT: 224.70986
SMILES: C1C(CS1)N2C3=CC=CC=C3N=C2Cl
Structure:
CAS RN: 136208-82-7
CAS Name: (8R)-8-hydroxy-7-(1-imidazolyl)-5,6,7,8-tetrahydronaphthalene-2-carboxylic acid hydrochloride
OPENEYE Name: (4R)-4-hydroxy-3-imidazol-1-yl-tetralin-6-carboxylic acid hydrochloride
IUPAC Name: (8R)-8-hydroxy-7-imidazol-1-yl-5,6,7,8-tetrahydronaphthalene-2-carboxylic acid hydrochloride
SYSTEMATIC NAME: (8R)-7-imidazol-1-yl-8-oxidanyl-5,6,7,8-tetrahydronaphthalene-2-carboxylic acid hydrochloride
MOLECULAR FORMULA: C14H15ClN2O3
MOLECULAR WEIGHT: 294.7335
SMILES: C1CC2=C(C=C(C=C2)C(=O)O)[C@H](C1N3C=CN=C3)O.Cl
Structure:
CAS RN: 136197-33-6
CAS Name: 4-(2-hydroxybutan-2-yl)-[1,3]thiazino[3,2-a]benzimidazol-2-one
OPENEYE Name: 4-(1-hydroxy-1-methyl-propyl)-[1,3]thiazino[3,2-a]benzimidazol-2-one
IUPAC Name: 4-(2-hydroxybutan-2-yl)-[1,3]thiazino[3,2-a]benzimidazol-2-one
SYSTEMATIC NAME: 4-(2-oxidanylbutan-2-yl)-[1,3]thiazino[3,2-a]benzimidazol-2-one
MOLECULAR FORMULA: C14H14N2O2S
MOLECULAR WEIGHT: 274.33816
SMILES: CCC(C)(C1=CC(=O)SC2=NC3=CC=CC=C3N12)O
Structure:
CAS RN: 136128-69-3
CAS Name: sodium; dimethyl-(phenylmethyl)-[2-[2-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]ethoxy]ethyl]ammonium; 3,8-dimethyl-5-propan-2-yl-1-azulenesulfonate; chloride
OPENEYE Name: sodium; benzyl-dimethyl-[2-[2-[4-(1,1,3,3-tetramethylbutyl)phenoxy]ethoxy]ethyl]ammonium; 5-isopropyl-3,8-dimethyl-azulene-1-sulfonate; chloride
IUPAC Name: sodium; benzyl-dimethyl-[2-[2-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]ethoxy]ethyl]azanium; 3,8-dimethyl-5-propan-2-ylazulene-1-sulfonate; chloride
SYSTEMATIC NAME: sodium; dimethyl-(phenylmethyl)-[2-[2-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]ethoxy]ethyl]azanium; 3,8-dimethyl-5-propan-2-yl-azulene-1-sulfonate; chloride
MOLECULAR FORMULA: C42H59ClNNaO5S
MOLECULAR WEIGHT: 748.42933
SMILES: CC1=C2C(=CC(=C2C=C(C=C1)C(C)C)C)S(=O)(=O)[O-].CC(C)(C)CC(C)(C)C1=CC=C(C=C1)OCCOCC[N+](C)(C)CC2=CC=CC=C2.[Na+].[Cl-]
Structure:
CAS RN: 136125-52-5
CAS Name: 1-(benzenesulfonyl)-5-prop-2-enoxy-2-pyrrolidinone
OPENEYE Name: 5-allyloxy-1-(benzenesulfonyl)pyrrolidin-2-one
IUPAC Name: 1-(benzenesulfonyl)-5-prop-2-enoxypyrrolidin-2-one
SYSTEMATIC NAME: 1-(phenylsulfonyl)-5-prop-2-enoxy-pyrrolidin-2-one
MOLECULAR FORMULA: C13H15NO4S
MOLECULAR WEIGHT: 281.3275
SMILES: C=CCOC1CCC(=O)N1S(=O)(=O)C2=CC=CC=C2
Structure:
CAS RN: 136105-26-5
CAS Name: disodium [(2S,3R,4R)-4-(4-amino-7-imidazo[4,5-d]triazinyl)-2-(oxidomethyl)-2-phosphonooxy-3-oxetanyl]methanolate
OPENEYE Name: disodium [(2S,3R,4R)-4-(4-aminoimidazo[4,5-d]triazin-7-yl)-2-(oxidomethyl)-2-phosphonooxy-oxetan-3-yl]methanolate
IUPAC Name: disodium [(2S,3R,4R)-4-(4-aminoimidazo[4,5-d]triazin-7-yl)-2-(oxidomethyl)-2-phosphonooxyoxetan-3-yl]methanolate
SYSTEMATIC NAME: disodium [(2S,3R,4R)-4-(4-azanylimidazo[4,5-d][1,2,3]triazin-7-yl)-2-(oxidanidylmethyl)-2-phosphonooxy-oxetan-3-yl]methanolate
MOLECULAR FORMULA: C9H11N6Na2O7P
MOLECULAR WEIGHT: 392.172941
SMILES: C1=NC2=C(N1[C@H]3[C@H]([C@@](O3)(C[O-])OP(=O)(O)O)C[O-])N=NN=C2N.[Na+].[Na+]
Structure:
CAS RN: 136105-25-4
CAS Name: [(2R,3R,4S)-2-(4-amino-7-imidazo[4,5-d]triazinyl)-4-(hydroxymethyl)-3-oxetanyl]methanol
OPENEYE Name: [(2R,3R,4S)-2-(4-aminoimidazo[4,5-d]triazin-7-yl)-4-(hydroxymethyl)oxetan-3-yl]methanol
IUPAC Name: [(2R,3R,4S)-2-(4-aminoimidazo[4,5-d]triazin-7-yl)-4-(hydroxymethyl)oxetan-3-yl]methanol
SYSTEMATIC NAME: [(2R,3R,4S)-2-(4-azanylimidazo[4,5-d][1,2,3]triazin-7-yl)-4-(hydroxymethyl)oxetan-3-yl]methanol
MOLECULAR FORMULA: C9H12N6O3
MOLECULAR WEIGHT: 252.22998
SMILES: C1=NC2=C(N1[C@H]3[C@@H]([C@H](O3)CO)CO)N=NN=C2N
Structure:
CAS RN: 136060-42-9
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C32H51NO9
MOLECULAR WEIGHT: 593.74864
SMILES: C[C@H]1CC[C@H]2[C@@](C3([C@H](CC4([C@@H]5CCC6[C@]7(C5(CC4([C@@H]3CN2C1)O)O[C@@]6([C@H](CC7)OC(=O)C(C)(C)C)O)C)O)O)O)(C)O
Structure:
CAS RN: 136060-11-2
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C36H51NO11
MOLECULAR WEIGHT: 673.79024
SMILES: C[C@H]1CC[C@H]2[C@@](C3([C@H](CC4([C@@H]5CCC6[C@]7(C5(CC4([C@@H]3CN2C1)O)O[C@@]6([C@H](CC7)OC(=O)C8=CC(=CC(=C8)OC)OC)O)C)O)O)O)(C)O
Structure:
CAS RN: 136051-80-4
CAS Name: 9-amino-5,6,7,8-tetrahydroacridin-2-ol
OPENEYE Name: 9-amino-5,6,7,8-tetrahydroacridin-2-ol
IUPAC Name: 9-amino-5,6,7,8-tetrahydroacridin-2-ol
SYSTEMATIC NAME: 9-azanyl-5,6,7,8-tetrahydroacridin-2-ol
MOLECULAR FORMULA: C13H14N2O
MOLECULAR WEIGHT: 214.26306
SMILES: C1CCC2=NC3=C(C=C(C=C3)O)C(=C2C1)N
Structure:
CAS RN: 135998-29-7
CAS Name: cyclohexane-1,2-diamine; 2-methyl-2-oxidobutanoate; platinum(2+)
OPENEYE Name: cyclohexane-1,2-diamine; 2-methyl-2-oxido-butanoate; platinum(2+)
IUPAC Name: cyclohexane-1,2-diamine; 2-methyl-2-oxidobutanoate; platinum(2+)
SYSTEMATIC NAME: cyclohexane-1,2-diamine; 2-methyl-2-oxidanidyl-butanoate; platinum(2+)
MOLECULAR FORMULA: C11H22N2O3Pt
MOLECULAR WEIGHT: 425.38198
SMILES: CCC(C)(C(=O)[O-])[O-].C1CCC(C(C1)N)N.[Pt+2]
Structure:
CAS RN: 135922-36-0
CAS Name: 7-(3-methyl-1-imidazol-3-iumyl)-5,6-dihydronaphthalene-2-carboxylate
OPENEYE Name: 7-(3-methylimidazol-3-ium-1-yl)-5,6-dihydronaphthalene-2-carboxylate
IUPAC Name: 7-(3-methylimidazol-3-ium-1-yl)-5,6-dihydronaphthalene-2-carboxylate
SYSTEMATIC NAME: 7-(3-methylimidazol-3-ium-1-yl)-5,6-dihydronaphthalene-2-carboxylate
MOLECULAR FORMULA: C15H14N2O2
MOLECULAR WEIGHT: 254.28386
SMILES: C[N+]1=CN(C=C1)C2=CC3=C(CC2)C=CC(=C3)C(=O)[O-]
Structure:
CAS RN: 135922-34-8
CAS Name: 7-(3-pyridinyl)-5,6-dihydronaphthalene-2-carboxylic acid
OPENEYE Name: 7-(3-pyridyl)-5,6-dihydronaphthalene-2-carboxylic acid
IUPAC Name: 7-pyridin-3-yl-5,6-dihydronaphthalene-2-carboxylic acid
SYSTEMATIC NAME: 7-pyridin-3-yl-5,6-dihydronaphthalene-2-carboxylic acid
MOLECULAR FORMULA: C16H13NO2
MOLECULAR WEIGHT: 251.27992
SMILES: C1CC(=CC2=C1C=CC(=C2)C(=O)O)C3=CN=CC=C3
Structure:
CAS RN: 135922-33-7
CAS Name: 6-(1-imidazolyl)-5,6,7,8-tetrahydronaphthalene-1-carboxylic acid
OPENEYE Name: 2-imidazol-1-yltetralin-5-carboxylic acid
IUPAC Name: 6-imidazol-1-yl-5,6,7,8-tetrahydronaphthalene-1-carboxylic acid
SYSTEMATIC NAME: 6-imidazol-1-yl-5,6,7,8-tetrahydronaphthalene-1-carboxylic acid
MOLECULAR FORMULA: C14H14N2O2
MOLECULAR WEIGHT: 242.27316
SMILES: C1CC2=C(C=CC=C2CC1N3C=CN=C3)C(=O)O
Structure:
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