CAS RN: 53862-81-0
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C31H49N3O10
MOLECULAR WEIGHT: 623.73486
SMILES: CC[C@H]1[C@@H]2C[C@H]3[C@H]4[C@@]5(C[C@@H](C2[C@H]5O)[N+]3([C@@H]1O)CC(CN(CC)CC)O)C6=CC=CC=C6N4C.[C@@H]([C@H](C(=O)[O-])O)(C(=O)O)O.O
Structure:
CAS RN: 21365-49-1
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C24H28Cl2F2O4
MOLECULAR WEIGHT: 489.379526
SMILES: C[C@]12C[C@@H]([C@]3([C@H]([C@@H]1C[C@@H]4[C@]2(OC(O4)(C)C)C(=O)CF)C[C@@H](C5=CC(=O)C=C[C@@]53C)F)Cl)Cl
Structure:
CAS RN: 77495-92-2
CAS Name: (2S,4R)-N-[(1S,2S)-2-chloro-1-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(methylthio)-2-oxanyl]propyl]-4-ethyl-2-piperidinecarboxamide hydrate hydrochloride
OPENEYE Name: (2S,4R)-N-[(1S,2S)-2-chloro-1-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-methylsulfanyl-tetrahydropyran-2-yl]propyl]-4-ethyl-piperidine-2-carboxamide hydrate hydrochloride
IUPAC Name: (2S,4R)-N-[(1S,2S)-2-chloro-1-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-methylsulfanyloxan-2-yl]propyl]-4-ethylpiperidine-2-carboxamide hydrate hydrochloride
SYSTEMATIC NAME: (2S,4R)-N-[(1S,2S)-2-chloranyl-1-[(2R,3R,4S,5R,6R)-6-methylsulfanyl-3,4,5-tris(oxidanyl)oxan-2-yl]propyl]-4-ethyl-piperidine-2-carboxamide hydrate hydrochloride
MOLECULAR FORMULA: C17H34Cl2N2O6S
MOLECULAR WEIGHT: 465.43266
SMILES: CC[C@@H]1CCN[C@@H](C1)C(=O)N[C@@H]([C@@H]2[C@@H]([C@@H]([C@H]([C@H](O2)SC)O)O)O)[C@H](C)Cl.O.Cl
Structure:
CAS RN: 63771-69-7
CAS Name: 5-[[[ethoxy-(propylthio)phosphoryl]thio]methyl]-3-methylisoxazole
OPENEYE Name: 5-[[ethoxy(propylsulfanyl)phosphoryl]sulfanylmethyl]-3-methyl-isoxazole
IUPAC Name: 5-[[ethoxy(propylsulfanyl)phosphoryl]sulfanylmethyl]-3-methyl-1,2-oxazole
SYSTEMATIC NAME: 5-[[ethoxy(propylsulfanyl)phosphoryl]sulfanylmethyl]-3-methyl-1,2-oxazole
MOLECULAR FORMULA: C10H18NO3PS2
MOLECULAR WEIGHT: 295.358581
SMILES: CCCSP(=O)(OCC)SCC1=CC(=NO1)C
Structure:
CAS RN: 41219-32-3
CAS Name: 6-chloro-4-(diethoxyphosphorylthio)-3,4-dihydro-2H-1-benzothiopyran
OPENEYE Name: 6-chloro-4-diethoxyphosphorylsulfanyl-thiochromane
IUPAC Name: 6-chloro-4-diethoxyphosphorylsulfanyl-3,4-dihydro-2H-thiochromene
SYSTEMATIC NAME: 6-chloranyl-4-diethoxyphosphorylsulfanyl-3,4-dihydro-2H-thiochromene
MOLECULAR FORMULA: C13H18ClO3PS2
MOLECULAR WEIGHT: 352.836981
SMILES: CCOP(=O)(OCC)SC1CCSC2=C1C=C(C=C2)Cl
Structure:
CAS RN: 31377-69-2
CAS Name: N,N-diethyl-4-[methoxy(methylamino)phosphoryl]oxy-6-methyl-2-pyrimidinamine
OPENEYE Name: N,N-diethyl-4-[methoxy(methylamino)phosphoryl]oxy-6-methyl-pyrimidin-2-amine
IUPAC Name: N,N-diethyl-4-[methoxy(methylamino)phosphoryl]oxy-6-methylpyrimidin-2-amine
SYSTEMATIC NAME: N,N-diethyl-4-[methoxy(methylamino)phosphoryl]oxy-6-methyl-pyrimidin-2-amine
MOLECULAR FORMULA: C11H21N4O3P
MOLECULAR WEIGHT: 288.283201
SMILES: CCN(CC)C1=NC(=CC(=N1)OP(=O)(NC)OC)C
Structure:
CAS RN: 25316-57-8
CAS Name: 2-[(5-bromo-6-oxo-1-phenyl-4-pyridazinyl)amino]-2-oxoacetic acid; 2-(dimethylamino)ethanol
OPENEYE Name: 2-[(5-bromo-6-oxo-1-phenyl-pyridazin-4-yl)amino]-2-oxo-acetic acid; 2-(dimethylamino)ethanol
IUPAC Name: 2-[(5-bromo-6-oxo-1-phenylpyridazin-4-yl)amino]-2-oxoacetic acid; 2-(dimethylamino)ethanol
SYSTEMATIC NAME: 2-[(5-bromanyl-6-oxidanylidene-1-phenyl-pyridazin-4-yl)amino]-2-oxidanylidene-ethanoic acid; 2-(dimethylamino)ethanol
MOLECULAR FORMULA: C16H19BrN4O5
MOLECULAR WEIGHT: 427.24986
SMILES: CN(C)CCO.C1=CC=C(C=C1)N2C(=O)C(=C(C=N2)NC(=O)C(=O)O)Br
Structure:
CAS RN: 27386-64-7
CAS Name: N-[1-[[2-(methylthio)ethylamino]-oxomethyl]-2-benzimidazolyl]carbamic acid methyl ester
OPENEYE Name: methyl N-[1-(2-methylsulfanylethylcarbamoyl)benzimidazol-2-yl]carbamate
IUPAC Name: methyl N-[1-(2-methylsulfanylethylcarbamoyl)benzimidazol-2-yl]carbamate
SYSTEMATIC NAME: methyl N-[1-(2-methylsulfanylethylcarbamoyl)benzimidazol-2-yl]carbamate
MOLECULAR FORMULA: C13H16N4O3S
MOLECULAR WEIGHT: 308.35614
SMILES: COC(=O)NC1=NC2=CC=CC=C2N1C(=O)NCCSC
Structure:
CAS RN: 38260-63-8
CAS Name: (6-ethoxy-2-propan-2-yl-4-pyrimidinyl)oxy-dimethoxy-sulfanylidenephosphorane
OPENEYE Name: (6-ethoxy-2-isopropyl-pyrimidin-4-yl)oxy-dimethoxy-thioxo-$l^{5}-phosphane
IUPAC Name: (6-ethoxy-2-propan-2-ylpyrimidin-4-yl)oxy-dimethoxy-sulfanylidene-$l^{5}-phosphane
SYSTEMATIC NAME: (6-ethoxy-2-propan-2-yl-pyrimidin-4-yl)oxy-dimethoxy-sulfanylidene-$l^{5}-phosphane
MOLECULAR FORMULA: C11H19N2O4PS
MOLECULAR WEIGHT: 306.318321
SMILES: CCOC1=CC(=NC(=N1)C(C)C)OP(=S)(OC)OC
Structure:
CAS RN: 25671-45-8
CAS Name: carbonic acid (4-cyano-2,6-diiodophenyl) prop-2-enyl ester
OPENEYE Name: allyl (4-cyano-2,6-diiodo-phenyl) carbonate
IUPAC Name: (4-cyano-2,6-diiodophenyl) prop-2-enyl carbonate
SYSTEMATIC NAME: [4-cyano-2,6-bis(iodanyl)phenyl] prop-2-enyl carbonate
MOLECULAR FORMULA: C11H7I2NO3
MOLECULAR WEIGHT: 454.98712
SMILES: C=CCOC(=O)OC1=C(C=C(C=C1I)C#N)I
Structure:
CAS RN: 24668-75-5
CAS Name: 3,3-dimethylbutanoic acid [2-[(8S,9R,10S,11S,13S,14S,16R,17R)-9-fluoro-11,17-dihydroxy-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] ester
OPENEYE Name: [2-[(8S,9R,10S,11S,13S,14S,16R,17R)-9-fluoro-11,17-dihydroxy-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl]-2-oxo-ethyl] 3,3-dimethylbutanoate
IUPAC Name: [2-[(8S,9R,10S,11S,13S,14S,16R,17R)-9-fluoro-11,17-dihydroxy-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] 3,3-dimethylbutanoate
SYSTEMATIC NAME: [2-[(8S,9R,10S,11S,13S,14S,16R,17R)-9-fluoranyl-10,13,16-trimethyl-11,17-bis(oxidanyl)-3-oxidanylidene-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl]-2-oxidanylidene-ethyl] 3,3-dimethylbutanoate
MOLECULAR FORMULA: C28H39FO6
MOLECULAR WEIGHT: 490.604063
SMILES: C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@@]4([C@]3([C@H](C[C@@]2([C@]1(C(=O)COC(=O)CC(C)(C)C)O)C)O)F)C
Structure:
CAS RN: 599-33-7
CAS Name: (8S,9S,10R,11S,13S,14S,17R)-11,17-dihydroxy-17-(2-hydroxy-1-oxoethyl)-10,13-dimethyl-16-methylene-6,7,8,9,11,12,14,15-octahydrocyclopenta[a]phenanthren-3-one
OPENEYE Name: (8S,9S,10R,11S,13S,14S,17R)-11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-16-methylene-6,7,8,9,11,12,14,15-octahydrocyclopenta[a]phenanthren-3-one
IUPAC Name: (8S,9S,10R,11S,13S,14S,17R)-11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-16-methylidene-6,7,8,9,11,12,14,15-octahydrocyclopenta[a]phenanthren-3-one
SYSTEMATIC NAME: (8S,9S,10R,11S,13S,14S,17R)-10,13-dimethyl-16-methylidene-11,17-bis(oxidanyl)-17-(2-oxidanylethanoyl)-6,7,8,9,11,12,14,15-octahydrocyclopenta[a]phenanthren-3-one
MOLECULAR FORMULA: C22H28O5
MOLECULAR WEIGHT: 372.45472
SMILES: C[C@]12C[C@@H]([C@H]3[C@H]([C@@H]1CC(=C)[C@@]2(C(=O)CO)O)CCC4=CC(=O)C=C[C@]34C)O
Structure:
CAS RN: 3564-09-8
CAS Name: disodium 3-oxo-4-[(2,4,5-trimethylphenyl)hydrazinylidene]naphthalene-2,7-disulfonate
OPENEYE Name: disodium 3-oxo-4-[(2,4,5-trimethylphenyl)hydrazono]naphthalene-2,7-disulfonate
IUPAC Name: disodium 3-oxo-4-[(2,4,5-trimethylphenyl)hydrazinylidene]naphthalene-2,7-disulfonate
SYSTEMATIC NAME: disodium 3-oxidanylidene-4-[(2,4,5-trimethylphenyl)hydrazinylidene]naphthalene-2,7-disulfonate
MOLECULAR FORMULA: C19H16N2Na2O7S2
MOLECULAR WEIGHT: 494.44908
SMILES: CC1=CC(=C(C=C1C)NN=C2C3=C(C=C(C=C3)S(=O)(=O)[O-])C=C(C2=O)S(=O)(=O)[O-])C.[Na+].[Na+]
Structure:
CAS RN: 14417-88-0
CAS Name: (9Z,12Z)-N-(1-phenylethyl)octadeca-9,12-dienamide
OPENEYE Name: (9Z,12Z)-N-(1-phenylethyl)octadeca-9,12-dienamide
IUPAC Name: (9Z,12Z)-N-(1-phenylethyl)octadeca-9,12-dienamide
SYSTEMATIC NAME: (9Z,12Z)-N-(1-phenylethyl)octadeca-9,12-dienamide
MOLECULAR FORMULA: C26H41NO
MOLECULAR WEIGHT: 383.60984
SMILES: CCCCC/C=C\C/C=C\CCCCCCCC(=O)NC(C)C1=CC=CC=C1
Structure:
No comments:
Post a Comment