CAS RN: 1185033-84-4
CAS Name: 5-[[4-[2-(5-acetyl-2-pyridinyl)-1,1,2,2-tetradeuterioethoxy]phenyl]methyl]thiazolidine-2,4-dione
OPENEYE Name: 5-[[4-[2-(5-acetyl-2-pyridyl)-1,1,2,2-tetradeuterio-ethoxy]phenyl]methyl]thiazolidine-2,4-dione
IUPAC Name: 5-[[4-[2-(5-acetylpyridin-2-yl)-1,1,2,2-tetradeuterioethoxy]phenyl]methyl]-1,3-thiazolidine-2,4-dione
SYSTEMATIC NAME: 5-[[4-[1,1,2,2-tetradeuterio-2-(5-ethanoylpyridin-2-yl)ethoxy]phenyl]methyl]-1,3-thiazolidine-2,4-dione
MOLECULAR FORMULA: C19H18N2O4S
MOLECULAR WEIGHT: 374.446867
SMILES: [2H]C([2H])(C1=NC=C(C=C1)C(=O)C)C([2H])([2H])OC2=CC=C(C=C2)CC3C(=O)NC(=O)S3
CAS RN: 1189959-59-8
CAS Name: 4-(2,1,3-benzoxadiazol-4-yl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid O3-propan-2-yl ester O5-(trideuteriomethyl) ester
OPENEYE Name: O3-isopropyl O5-(trideuteriomethyl) 4-(2,1,3-benzoxadiazol-4-yl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
IUPAC Name: 3-O-propan-2-yl 5-O-(trideuteriomethyl) 4-(2,1,3-benzoxadiazol-4-yl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
SYSTEMATIC NAME: O3-propan-2-yl O5-(trideuteriomethyl) 4-(2,1,3-benzoxadiazol-4-yl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
MOLECULAR FORMULA: C19H21N3O5
MOLECULAR WEIGHT: 374.405625
SMILES: [2H]C([2H])([2H])OC(=O)C1=C(NC(=C(C1C2=CC=CC3=NON=C32)C(=O)OC(C)C)C)C
CAS RN: 1185120-76-6
CAS Name: 7-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]-8-(4,4,4-trideuteriobutyl)-7,9-diazaspiro[4.4]non-8-en-6-one
OPENEYE Name: 7-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]-8-(4,4,4-trideuteriobutyl)-7,9-diazaspiro[4.4]non-8-en-6-one
IUPAC Name: 7-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]-8-(4,4,4-trideuteriobutyl)-7,9-diazaspiro[4.4]non-8-en-6-one
SYSTEMATIC NAME: 7-[[4-[2-(2H-1,2,3,4-tetrazol-5-yl)phenyl]phenyl]methyl]-8-(4,4,4-trideuteriobutyl)-7,9-diazaspiro[4.4]non-8-en-6-one
MOLECULAR FORMULA: C25H28N6O
MOLECULAR WEIGHT: 431.547905
SMILES: [2H]C([2H])([2H])CCCC1=NC2(CCCC2)C(=O)N1CC3=CC=C(C=C3)C4=CC=CC=C4C5=NNN=N5
CAS RN: 1189993-66-5
CAS Name: sulfuric acid [4-[3-(1,1,1,2,3,3,3-heptadeuteriopropan-2-ylamino)-2-hydroxypropoxy]-1-naphthalenyl] ester
OPENEYE Name: [4-[2-hydroxy-3-[[1,2,2,2-tetradeuterio-1-(trideuteriomethyl)ethyl]amino]propoxy]-1-naphthyl] hydrogen sulfate
IUPAC Name: [4-[3-(1,1,1,2,3,3,3-heptadeuteriopropan-2-ylamino)-2-hydroxypropoxy]naphthalen-1-yl] hydrogen sulfate
SYSTEMATIC NAME: [4-[3-(1,1,1,2,3,3,3-heptadeuteriopropan-2-ylamino)-2-oxidanyl-propoxy]naphthalen-1-yl] hydrogen sulfate
MOLECULAR FORMULA: C16H21NO6S
MOLECULAR WEIGHT: 362.449172
SMILES: [2H]C([2H])([2H])C([2H])(C([2H])([2H])[2H])NCC(COC1=CC=C(C2=CC=CC=C21)OS(=O)(=O)O)O
CAS RN: 1219908-86-7
CAS Name: 4-[3-(1,1,1,2,3,3,3-heptadeuteriopropan-2-ylamino)-2-hydroxypropoxy]-1-naphthalenol
OPENEYE Name: 4-[2-hydroxy-3-[[1,2,2,2-tetradeuterio-1-(trideuteriomethyl)ethyl]amino]propoxy]naphthalen-1-ol
IUPAC Name: 4-[3-(1,1,1,2,3,3,3-heptadeuteriopropan-2-ylamino)-2-hydroxypropoxy]naphthalen-1-ol
SYSTEMATIC NAME: 4-[3-(1,1,1,2,3,3,3-heptadeuteriopropan-2-ylamino)-2-oxidanyl-propoxy]naphthalen-1-ol
MOLECULAR FORMULA: C16H21NO3
MOLECULAR WEIGHT: 282.385972
SMILES: [2H]C([2H])([2H])C([2H])(C([2H])([2H])[2H])NCC(COC1=CC=C(C2=CC=CC=C21)O)O
CAS RN: 1189675-28-2
CAS Name: 4-[2-[[3-(9H-carbazol-4-yloxy)-2-hydroxypropyl]amino]ethoxy]-3-(trideuteriomethoxy)phenol
OPENEYE Name: 4-[2-[[3-(9H-carbazol-4-yloxy)-2-hydroxy-propyl]amino]ethoxy]-3-(trideuteriomethoxy)phenol
IUPAC Name: 4-[2-[[3-(9H-carbazol-4-yloxy)-2-hydroxypropyl]amino]ethoxy]-3-(trideuteriomethoxy)phenol
SYSTEMATIC NAME: 4-[2-[[3-(9H-carbazol-4-yloxy)-2-oxidanyl-propyl]amino]ethoxy]-3-(trideuteriomethoxy)phenol
MOLECULAR FORMULA: C24H26N2O5
MOLECULAR WEIGHT: 425.492125
SMILES: [2H]C([2H])([2H])OC1=C(C=CC(=C1)O)OCCNCC(COC2=CC=CC3=C2C4=CC=CC=C4N3)O
CAS RN: 1173022-56-4
CAS Name: 5-ethyl-5-(4-hydroxyphenyl)-3-(trideuteriomethyl)imidazolidine-2,4-dione
OPENEYE Name: 5-ethyl-5-(4-hydroxyphenyl)-3-(trideuteriomethyl)imidazolidine-2,4-dione
IUPAC Name: 5-ethyl-5-(4-hydroxyphenyl)-3-(trideuteriomethyl)imidazolidine-2,4-dione
SYSTEMATIC NAME: 5-ethyl-5-(4-hydroxyphenyl)-3-(trideuteriomethyl)imidazolidine-2,4-dione
MOLECULAR FORMULA: C12H14N2O3
MOLECULAR WEIGHT: 237.269645
SMILES: [2H]C([2H])([2H])N1C(=O)C(NC1=O)(CC)C2=CC=C(C=C2)O
CAS RN: 1185069-74-2
CAS Name: 2-[[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]amino]-1-[7-(1-hydroxyethyl)-2-benzofuranyl]ethanol
OPENEYE Name: 1-[7-(1-hydroxyethyl)benzofuran-2-yl]-2-[[2,2,2-trideuterio-1,1-bis(trideuteriomethyl)ethyl]amino]ethanol
IUPAC Name: 2-[[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]amino]-1-[7-(1-hydroxyethyl)-1-benzofuran-2-yl]ethanol
SYSTEMATIC NAME: 2-[[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]amino]-1-[7-(1-hydroxyethyl)-1-benzofuran-2-yl]ethanol
MOLECULAR FORMULA: C16H23NO3
MOLECULAR WEIGHT: 286.414176
SMILES: [2H]C([2H])([2H])C(C([2H])([2H])[2H])(C([2H])([2H])[2H])NCC(C1=CC2=C(O1)C(=CC=C2)C(C)O)O
CAS RN: 1190006-03-1
CAS Name: 6-chloro-3,3-dideuterio-1,1-dioxo-2,4-dihydro-1$l^{6},2,4-benzothiadiazine-7-sulfonamide
OPENEYE Name: 6-chloro-3,3-dideuterio-1,1-dioxo-2,4-dihydro-1$l^{6},2,4-benzothiadiazine-7-sulfonamide
IUPAC Name: 6-chloro-3,3-dideuterio-1,1-dioxo-2,4-dihydro-1$l^{6},2,4-benzothiadiazine-7-sulfonamide
SYSTEMATIC NAME: 6-chloranyl-3,3-dideuterio-1,1-bis(oxidanylidene)-2,4-dihydro-1$l^{6},2,4-benzothiadiazine-7-sulfonamide
MOLECULAR FORMULA: C7H8ClN3O4S2
MOLECULAR WEIGHT: 300.744098
SMILES: [2H][13C]1(NC2=CC(=C(C=C2S(=O)(=O)N1)S(=O)(=O)N)Cl)[2H]
CAS RN: 1189482-35-6
CAS Name: 4-chloro-2-[[dideuterio-(3,4,5-trideuterio-2-furanyl)methyl]amino]-5-sulfamoylbenzoic acid
OPENEYE Name: 4-chloro-2-[[dideuterio-(3,4,5-trideuterio-2-furyl)methyl]amino]-5-sulfamoyl-benzoic acid
IUPAC Name: 4-chloro-2-[[dideuterio-(3,4,5-trideuteriofuran-2-yl)methyl]amino]-5-sulfamoylbenzoic acid
SYSTEMATIC NAME: 4-chloranyl-2-[[dideuterio-(3,4,5-trideuteriofuran-2-yl)methyl]amino]-5-sulfamoyl-benzoic acid
MOLECULAR FORMULA: C12H11ClN2O5S
MOLECULAR WEIGHT: 335.774949
SMILES: [2H]C1=C(OC(=C1[2H])C([2H])([2H])NC2=CC(=C(C=C2C(=O)O)S(=O)(=O)N)Cl)[2H]
CAS RN: 1020719-45-2
CAS Name: N-[5-[2-[[1,1,1,2,3,3-hexadeuterio-3-(4-methoxyphenyl)propan-2-yl]amino]-1-hydroxyethyl]-2-hydroxyphenyl]formamide
OPENEYE Name: N-[2-hydroxy-5-[1-hydroxy-2-[[1,2,2,2-tetradeuterio-1-[dideuterio-(4-methoxyphenyl)methyl]ethyl]amino]ethyl]phenyl]formamide
IUPAC Name: N-[5-[2-[[1,1,1,2,3,3-hexadeuterio-3-(4-methoxyphenyl)propan-2-yl]amino]-1-hydroxyethyl]-2-hydroxyphenyl]formamide
SYSTEMATIC NAME: N-[5-[2-[[1,1,1,2,3,3-hexadeuterio-3-(4-methoxyphenyl)propan-2-yl]amino]-1-oxidanyl-ethyl]-2-oxidanyl-phenyl]methanamide
MOLECULAR FORMULA: C19H24N2O4
MOLECULAR WEIGHT: 350.441831
SMILES: [2H]C([2H])([2H])C([2H])(C([2H])([2H])C1=CC=C(C=C1)OC)NCC(C2=CC(=C(C=C2)O)NC=O)O
CAS RN: 1173147-79-9
CAS Name: N-methyl-3-(2,3,4,5,6-pentadeuteriophenyl)-3-[4-(trifluoromethyl)phenoxy]-1-propanamine
OPENEYE Name: N-methyl-3-(2,3,4,5,6-pentadeuteriophenyl)-3-[4-(trifluoromethyl)phenoxy]propan-1-amine
IUPAC Name: N-methyl-3-(2,3,4,5,6-pentadeuteriophenyl)-3-[4-(trifluoromethyl)phenoxy]propan-1-amine
SYSTEMATIC NAME: N-methyl-3-(2,3,4,5,6-pentadeuteriophenyl)-3-[4-(trifluoromethyl)phenoxy]propan-1-amine
MOLECULAR FORMULA: C17H18F3NO
MOLECULAR WEIGHT: 314.356938
SMILES: [2H]C1=C(C(=C(C(=C1[2H])[2H])C(CCNC)OC2=CC=C(C=C2)C(F)(F)F)[2H])[2H]
CAS RN: 1173020-43-3
CAS Name: N-methyl-3-(2,3,4,5,6-pentadeuteriophenyl)-3-[4-(trifluoromethyl)phenoxy]-1-propanamine hydrochloride
OPENEYE Name: N-methyl-3-(2,3,4,5,6-pentadeuteriophenyl)-3-[4-(trifluoromethyl)phenoxy]propan-1-amine hydrochloride
IUPAC Name: N-methyl-3-(2,3,4,5,6-pentadeuteriophenyl)-3-[4-(trifluoromethyl)phenoxy]propan-1-amine hydrochloride
SYSTEMATIC NAME: N-methyl-3-(2,3,4,5,6-pentadeuteriophenyl)-3-[4-(trifluoromethyl)phenoxy]propan-1-amine hydrochloride
MOLECULAR FORMULA: C17H19ClF3NO
MOLECULAR WEIGHT: 350.817878
SMILES: [2H]C1=C(C(=C(C(=C1[2H])[2H])C(CCNC)OC2=CC=C(C=C2)C(F)(F)F)[2H])[2H].Cl
CAS RN: 118357-29-2
CAS Name: N-(2,3,4,5,6-pentadeuteriophenyl)-N-[1-(2-phenylethyl)-4-piperidinyl]propanamide
OPENEYE Name: N-(2,3,4,5,6-pentadeuteriophenyl)-N-[1-(2-phenylethyl)-4-piperidyl]propanamide
IUPAC Name: N-(2,3,4,5,6-pentadeuteriophenyl)-N-[1-(2-phenylethyl)piperidin-4-yl]propanamide
SYSTEMATIC NAME: N-(2,3,4,5,6-pentadeuteriophenyl)-N-[1-(2-phenylethyl)piperidin-4-yl]propanamide
MOLECULAR FORMULA: C22H28N2O
MOLECULAR WEIGHT: 341.501329
SMILES: [2H]C1=C(C(=C(C(=C1[2H])[2H])N(C2CCN(CC2)CCC3=CC=CC=C3)C(=O)CC)[2H])[2H]
CAS RN: 774173-70-5
CAS Name: (2,2,2-trideuterio-1-hydroxy-1-phosphonoethyl)phosphonic acid
OPENEYE Name: (2,2,2-trideuterio-1-hydroxy-1-phosphono-ethyl)phosphonic acid
IUPAC Name: (2,2,2-trideuterio-1-hydroxy-1-phosphonoethyl)phosphonic acid
SYSTEMATIC NAME: (2,2,2-trideuterio-1-oxidanyl-1-phosphono-ethyl)phosphonic acid
MOLECULAR FORMULA: C2H8O7P2
MOLECULAR WEIGHT: 209.046727
SMILES: [2H]C([2H])([2H])C(O)(P(=O)(O)O)P(=O)(O)O
CAS RN: 350820-06-3
CAS Name: (8R,9S,13S,14S,17R)-2,4,16,16-tetradeuterio-17-ethynyl-13-methyl-6,7,8,9,11,12,14,15-octahydrocyclopenta[a]phenanthrene-3,17-diol
OPENEYE Name: (8R,9S,13S,14S,17R)-2,4,16,16-tetradeuterio-17-ethynyl-13-methyl-6,7,8,9,11,12,14,15-octahydrocyclopenta[a]phenanthrene-3,17-diol
IUPAC Name: (8R,9S,13S,14S,17R)-2,4,16,16-tetradeuterio-17-ethynyl-13-methyl-6,7,8,9,11,12,14,15-octahydrocyclopenta[a]phenanthrene-3,17-diol
SYSTEMATIC NAME: (8R,9S,13S,14S,17R)-2,4,16,16-tetradeuterio-17-ethynyl-13-methyl-6,7,8,9,11,12,14,15-octahydrocyclopenta[a]phenanthrene-3,17-diol
MOLECULAR FORMULA: C20H24O2
MOLECULAR WEIGHT: 300.428007
SMILES: [2H]C1=CC2=C(CC[C@@H]3[C@@H]2CC[C@]4([C@H]3CC([C@]4(C#C)O)([2H])[2H])C)C(=C1O)[2H]
CAS RN: 203633-19-6
CAS Name: 4-(2-amino-1,1,2,2-tetradeuterioethyl)benzene-1,2-diol hydrochloride
OPENEYE Name: 4-(2-amino-1,1,2,2-tetradeuterio-ethyl)benzene-1,2-diol hydrochloride
IUPAC Name: 4-(2-amino-1,1,2,2-tetradeuterioethyl)benzene-1,2-diol hydrochloride
SYSTEMATIC NAME: 4-(2-azanyl-1,1,2,2-tetradeuterio-ethyl)benzene-1,2-diol hydrochloride
MOLECULAR FORMULA: C8H12ClNO2
MOLECULAR WEIGHT: 193.664027
SMILES: [2H]C([2H])(C1=CC(=C(C=C1)O)O)C([2H])([2H])N.Cl
CAS RN: 1020719-39-4
CAS Name: 1,2,3,4-tetradeuterio-6-hydroxy-5,6-dihydrobenzo[b][1]benzazepine-11-carboxamide
OPENEYE Name: 1,2,3,4-tetradeuterio-6-hydroxy-5,6-dihydrobenzo[b][1]benzazepine-11-carboxamide
IUPAC Name: 1,2,3,4-tetradeuterio-6-hydroxy-5,6-dihydrobenzo[b][1]benzazepine-11-carboxamide
SYSTEMATIC NAME: 1,2,3,4-tetradeuterio-6-oxidanyl-5,6-dihydrobenzo[b][1]benzazepine-11-carboxamide
MOLECULAR FORMULA: C15H14N2O2
MOLECULAR WEIGHT: 258.308507
SMILES: [2H]C1=C(C(=C2C(=C1[2H])CC(C3=CC=CC=C3N2C(=O)N)O)[2H])[2H]
CAS RN: 1189929-21-2
CAS Name: 5-hydroxy-6-methoxy-2-[[1-[(2,3,4,5,6-pentadeuteriophenyl)methyl]-4-piperidinyl]methyl]-2,3-dihydroinden-1-one
OPENEYE Name: 5-hydroxy-6-methoxy-2-[[1-[(2,3,4,5,6-pentadeuteriophenyl)methyl]-4-piperidyl]methyl]indan-1-one
IUPAC Name: 5-hydroxy-6-methoxy-2-[[1-[(2,3,4,5,6-pentadeuteriophenyl)methyl]piperidin-4-yl]methyl]-2,3-dihydroinden-1-one
SYSTEMATIC NAME: 6-methoxy-5-oxidanyl-2-[[1-[(2,3,4,5,6-pentadeuteriophenyl)methyl]piperidin-4-yl]methyl]-2,3-dihydroinden-1-one
MOLECULAR FORMULA: C23H27NO3
MOLECULAR WEIGHT: 370.496189
SMILES: [2H]C1=C(C(=C(C(=C1[2H])[2H])CN2CCC(CC2)CC3CC4=CC(=C(C=C4C3=O)OC)O)[2H])[2H]
CAS RN: 1173023-19-2
CAS Name: 4-[(7-chloro-4-quinolinyl)amino]-2-[(1,1,2,2,2-pentadeuterioethylamino)methyl]phenol
OPENEYE Name: 4-[(7-chloro-4-quinolyl)amino]-2-[(1,1,2,2,2-pentadeuterioethylamino)methyl]phenol
IUPAC Name: 4-[(7-chloroquinolin-4-yl)amino]-2-[(1,1,2,2,2-pentadeuterioethylamino)methyl]phenol
SYSTEMATIC NAME: 4-[(7-chloranylquinolin-4-yl)amino]-2-[(1,1,2,2,2-pentadeuterioethylamino)methyl]phenol
MOLECULAR FORMULA: C18H18ClN3O
MOLECULAR WEIGHT: 332.838829
SMILES: [2H]C([2H])([2H])C([2H])([2H])NCC1=C(C=CC(=C1)NC2=C3C=CC(=CC3=NC=C2)Cl)O
CAS RN: 1189960-80-2
CAS Name: (2-butyl-3-benzofuranyl)-[3,5-diiodo-4-[1,1,2,2-tetradeuterio-2-(ethylamino)ethoxy]phenyl]methanone hydrochloride
OPENEYE Name: (2-butylbenzofuran-3-yl)-[3,5-diiodo-4-[1,1,2,2-tetradeuterio-2-(ethylamino)ethoxy]phenyl]methanone hydrochloride
IUPAC Name: (2-butyl-1-benzofuran-3-yl)-[3,5-diiodo-4-[1,1,2,2-tetradeuterio-2-(ethylamino)ethoxy]phenyl]methanone hydrochloride
SYSTEMATIC NAME: [3,5-bis(iodanyl)-4-[1,1,2,2-tetradeuterio-2-(ethylamino)ethoxy]phenyl]-(2-butyl-1-benzofuran-3-yl)methanone hydrochloride
MOLECULAR FORMULA: C23H26ClI2NO3
MOLECULAR WEIGHT: 657.744027
SMILES: [2H]C([2H])(C([2H])([2H])OC1=C(C=C(C=C1I)C(=O)C2=C(OC3=CC=CC=C32)CCCC)I)NCC.Cl
CAS RN: 1184978-11-7
CAS Name: (2-butyl-3-benzofuranyl)-[3,5-diiodo-4-[1,1,2,2-tetradeuterio-2-(ethylamino)ethoxy]phenyl]methanone
OPENEYE Name: (2-butylbenzofuran-3-yl)-[3,5-diiodo-4-[1,1,2,2-tetradeuterio-2-(ethylamino)ethoxy]phenyl]methanone
IUPAC Name: (2-butyl-1-benzofuran-3-yl)-[3,5-diiodo-4-[1,1,2,2-tetradeuterio-2-(ethylamino)ethoxy]phenyl]methanone
SYSTEMATIC NAME: [3,5-bis(iodanyl)-4-[1,1,2,2-tetradeuterio-2-(ethylamino)ethoxy]phenyl]-(2-butyl-1-benzofuran-3-yl)methanone
MOLECULAR FORMULA: C23H25I2NO3
MOLECULAR WEIGHT: 621.283087
SMILES: [2H]C([2H])(C([2H])([2H])OC1=C(C=C(C=C1I)C(=O)C2=C(OC3=CC=CC=C32)CCCC)I)NCC
CAS RN: 125464-52-0
CAS Name: 2,6-dimethyl-4-(2-nitrophenyl)pyridine-3,5-dicarboxylic acid bis(trideuteriomethyl) ester
OPENEYE Name: bis(trideuteriomethyl) 2,6-dimethyl-4-(2-nitrophenyl)pyridine-3,5-dicarboxylate
IUPAC Name: bis(trideuteriomethyl) 2,6-dimethyl-4-(2-nitrophenyl)pyridine-3,5-dicarboxylate
SYSTEMATIC NAME: bis(trideuteriomethyl) 2,6-dimethyl-4-(2-nitrophenyl)pyridine-3,5-dicarboxylate
MOLECULAR FORMULA: C17H16N2O6
MOLECULAR WEIGHT: 350.355711
SMILES: [2H]C([2H])([2H])OC(=O)C1=C(N=C(C(=C1C2=CC=CC=C2[N+](=O)[O-])C(=O)OC([2H])([2H])[2H])C)C
CAS RN: 1184983-42-3
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C20H22ClN
MOLECULAR WEIGHT: 314.866865
SMILES: [2H]C([2H])([2H])N(C)CCC=C1C2=CC=CC=C2C=CC3=CC=CC=C31.Cl
CAS RN: 544686-21-7
CAS Name: 4-[5-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]-3-(trifluoromethyl)-1-pyrazolyl]benzenesulfonamide
OPENEYE Name: 4-[5-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]-3-(trifluoromethyl)pyrazol-1-yl]benzenesulfonamide
IUPAC Name: 4-[5-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]-3-(trifluoromethyl)pyrazol-1-yl]benzenesulfonamide
SYSTEMATIC NAME: 4-[5-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]-3-(trifluoromethyl)pyrazol-1-yl]benzenesulfonamide
MOLECULAR FORMULA: C17H14F3N3O2S
MOLECULAR WEIGHT: 388.415302
SMILES: [2H]C1=C(C(=C(C(=C1C2=CC(=NN2C3=CC=C(C=C3)S(=O)(=O)N)C(F)(F)F)[2H])[2H])C([2H])([2H])[2H])[2H]
CAS RN: 1189650-58-5
CAS Name: 2-(1,1,2,2,2-pentadeuterioethoxy)-3-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]-4-benzimidazolecarboxylic acid
OPENEYE Name: 2-(1,1,2,2,2-pentadeuterioethoxy)-3-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]benzimidazole-4-carboxylic acid
IUPAC Name: 2-(1,1,2,2,2-pentadeuterioethoxy)-3-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]benzimidazole-4-carboxylic acid
SYSTEMATIC NAME: 2-(1,1,2,2,2-pentadeuterioethoxy)-3-[[4-[2-(2H-1,2,3,4-tetrazol-5-yl)phenyl]phenyl]methyl]benzimidazole-4-carboxylic acid
MOLECULAR FORMULA: C24H20N6O3
MOLECULAR WEIGHT: 445.484809
SMILES: [2H]C([2H])([2H])C([2H])([2H])OC1=NC2=CC=CC(=C2N1CC3=CC=C(C=C3)C4=CC=CC=C4C5=NNN=N5)C(=O)O
CAS RN: 1189725-26-5
CAS Name: 1-(3-chlorophenyl)-2-[[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]amino]-1-propanone hydrochloride
OPENEYE Name: 1-(3-chlorophenyl)-2-[[2,2,2-trideuterio-1,1-bis(trideuteriomethyl)ethyl]amino]propan-1-one hydrochloride
IUPAC Name: 1-(3-chlorophenyl)-2-[[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]amino]propan-1-one hydrochloride
SYSTEMATIC NAME: 1-(3-chlorophenyl)-2-[[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]amino]propan-1-one hydrochloride
MOLECULAR FORMULA: C13H19Cl2NO
MOLECULAR WEIGHT: 285.257516
SMILES: [2H]C([2H])([2H])C(C([2H])([2H])[2H])(C([2H])([2H])[2H])NC(C)C(=O)C1=CC(=CC=C1)Cl.Cl
CAS RN: 1173148-05-4
CAS Name: 1-(7-ethyl-2-benzofuranyl)-2-[[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]amino]ethanol
OPENEYE Name: 1-(7-ethylbenzofuran-2-yl)-2-[[2,2,2-trideuterio-1,1-bis(trideuteriomethyl)ethyl]amino]ethanol
IUPAC Name: 1-(7-ethyl-1-benzofuran-2-yl)-2-[[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]amino]ethanol
SYSTEMATIC NAME: 1-(7-ethyl-1-benzofuran-2-yl)-2-[[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]amino]ethanol
MOLECULAR FORMULA: C16H23NO2
MOLECULAR WEIGHT: 270.414776
SMILES: [2H]C([2H])([2H])C(C([2H])([2H])[2H])(C([2H])([2H])[2H])NCC(C1=CC2=C(O1)C(=CC=C2)CC)O
CAS RN: 1173023-51-2
CAS Name: 1-(7-ethyl-2-benzofuranyl)-2-[[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]amino]ethanol hydrochloride
OPENEYE Name: 1-(7-ethylbenzofuran-2-yl)-2-[[2,2,2-trideuterio-1,1-bis(trideuteriomethyl)ethyl]amino]ethanol hydrochloride
IUPAC Name: 1-(7-ethyl-1-benzofuran-2-yl)-2-[[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]amino]ethanol hydrochloride
SYSTEMATIC NAME: 1-(7-ethyl-1-benzofuran-2-yl)-2-[[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]amino]ethanol hydrochloride
MOLECULAR FORMULA: C16H24ClNO2
MOLECULAR WEIGHT: 306.875716
SMILES: [2H]C([2H])([2H])C(C([2H])([2H])[2H])(C([2H])([2H])[2H])NCC(C1=CC2=C(O1)C(=CC=C2)CC)O.Cl
CAS RN: 1217169-60-2
CAS Name: (2-butyl-3-benzofuranyl)-[3,5-diiodo-4-[1,1,2,2-tetradeuterio-2-(diethylamino)ethoxy]phenyl]methanone
OPENEYE Name: (2-butylbenzofuran-3-yl)-[3,5-diiodo-4-[1,1,2,2-tetradeuterio-2-(diethylamino)ethoxy]phenyl]methanone
IUPAC Name: (2-butyl-1-benzofuran-3-yl)-[3,5-diiodo-4-[1,1,2,2-tetradeuterio-2-(diethylamino)ethoxy]phenyl]methanone
SYSTEMATIC NAME: [3,5-bis(iodanyl)-4-[1,1,2,2-tetradeuterio-2-(diethylamino)ethoxy]phenyl]-(2-butyl-1-benzofuran-3-yl)methanone
MOLECULAR FORMULA: C25H29I2NO3
MOLECULAR WEIGHT: 649.336247
SMILES: [2H]C([2H])(C([2H])([2H])OC1=C(C=C(C=C1I)C(=O)C2=C(OC3=CC=CC=C32)CCCC)I)N(CC)CC
CAS RN: 1216715-80-8
CAS Name: (2-butyl-3-benzofuranyl)-[3,5-diiodo-4-[1,1,2,2-tetradeuterio-2-(diethylamino)ethoxy]phenyl]methanone hydrochloride
OPENEYE Name: (2-butylbenzofuran-3-yl)-[3,5-diiodo-4-[1,1,2,2-tetradeuterio-2-(diethylamino)ethoxy]phenyl]methanone hydrochloride
IUPAC Name: (2-butyl-1-benzofuran-3-yl)-[3,5-diiodo-4-[1,1,2,2-tetradeuterio-2-(diethylamino)ethoxy]phenyl]methanone hydrochloride
SYSTEMATIC NAME: [3,5-bis(iodanyl)-4-[1,1,2,2-tetradeuterio-2-(diethylamino)ethoxy]phenyl]-(2-butyl-1-benzofuran-3-yl)methanone hydrochloride
MOLECULAR FORMULA: C25H30ClI2NO3
MOLECULAR WEIGHT: 685.797187
SMILES: [2H]C([2H])(C([2H])([2H])OC1=C(C=C(C=C1I)C(=O)C2=C(OC3=CC=CC=C32)CCCC)I)N(CC)CC.Cl
CAS RN: 36082-45-8
CAS Name: 5-bromo-4-methoxy-2-pyrimidinamine
OPENEYE Name: 5-bromo-4-methoxy-pyrimidin-2-amine
IUPAC Name: 5-bromo-4-methoxypyrimidin-2-amine
SYSTEMATIC NAME: 5-bromanyl-4-methoxy-pyrimidin-2-amine
MOLECULAR FORMULA: C5H6BrN3O
MOLECULAR WEIGHT: 204.02464
SMILES: COC1=NC(=NC=C1Br)N
CAS RN: 910444-80-3
CAS Name: 2-(1-naphthalenyl)piperazine
OPENEYE Name: 2-(1-naphthyl)piperazine
IUPAC Name: 2-naphthalen-1-ylpiperazine
SYSTEMATIC NAME: 2-naphthalen-1-ylpiperazine
MOLECULAR FORMULA: C14H16N2
MOLECULAR WEIGHT: 212.29024
SMILES: C1CNC(CN1)C2=CC=CC3=CC=CC=C32
CAS RN: 721920-84-9
CAS Name: 2-(4-chlorophenyl)-5-thiazolecarboxaldehyde
OPENEYE Name: 2-(4-chlorophenyl)thiazole-5-carbaldehyde
IUPAC Name: 2-(4-chlorophenyl)-1,3-thiazole-5-carbaldehyde
SYSTEMATIC NAME: 2-(4-chlorophenyl)-1,3-thiazole-5-carbaldehyde
MOLECULAR FORMULA: C10H6ClNOS
MOLECULAR WEIGHT: 223.67874
SMILES: C1=CC(=CC=C1C2=NC=C(S2)C=O)Cl
CAS RN: 59229-14-0
CAS Name: 1-[3,5-bis(phenylmethoxy)phenyl]-2,2-dihydroxyethanone
OPENEYE Name: 1-(3,5-dibenzyloxyphenyl)-2,2-dihydroxy-ethanone
IUPAC Name: 1-[3,5-bis(phenylmethoxy)phenyl]-2,2-dihydroxyethanone
SYSTEMATIC NAME: 1-[3,5-bis(phenylmethoxy)phenyl]-2,2-bis(oxidanyl)ethanone
MOLECULAR FORMULA: C22H20O5
MOLECULAR WEIGHT: 364.3912
SMILES: C1=CC=C(C=C1)COC2=CC(=CC(=C2)C(=O)C(O)O)OCC3=CC=CC=C3
CAS RN: 153756-25-3
CAS Name: diaminomethylideneammonium; trifluoromethanesulfonate
OPENEYE Name: diaminomethyleneammonium; trifluoromethanesulfonate
IUPAC Name: diaminomethylideneazanium; trifluoromethanesulfonate
SYSTEMATIC NAME: bis(azanyl)methylideneazanium; tris(fluoranyl)methanesulfonate
MOLECULAR FORMULA: C2H6F3N3O3S
MOLECULAR WEIGHT: 209.14755
SMILES: C(=[NH2+])(N)N.C(F)(F)(F)S(=O)(=O)[O-]
CAS RN: 712355-11-8
CAS Name: 1-butyl-1-methylpyrrolidin-1-ium; 2,2,2-trifluoroacetate
OPENEYE Name: 1-butyl-1-methyl-pyrrolidin-1-ium; 2,2,2-trifluoroacetate
IUPAC Name: 1-butyl-1-methylpyrrolidin-1-ium; 2,2,2-trifluoroacetate
SYSTEMATIC NAME: 1-butyl-1-methyl-pyrrolidin-1-ium; 2,2,2-tris(fluoranyl)ethanoate
MOLECULAR FORMULA: C11H20F3NO2
MOLECULAR WEIGHT: 255.27721
SMILES: CCCC[N+]1(CCCC1)C.C(=O)(C(F)(F)F)[O-]
CAS RN: 872702-36-8
CAS Name:
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MOLECULAR FORMULA: C95H168N41O33P3S
MOLECULAR WEIGHT: 2537.591603
SMILES: CC(=O)NC(CCCCNC(=O)CSCCNC(=O)CCNC(=O)[C@@H](C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C2N=CN=C3N)O)OP(=O)(O)O)O)C(=O)NC(CC4=CC=C(C=C4)O)C(=O)NCC(=O)NC(CCCNC(=N)N)C(=O)NC(CCCCN)C(=O)NC(CCCCN)C(=O)NC(CCCNC(=N)N)C(=O)NC(CCCNC(=N)N)C(=O
CAS RN: 485318-10-3
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MOLECULAR FORMULA: C4H3N9Na+
MOLECULAR WEIGHT: 200.11669
SMILES: C1(=NC2=NNN=C3N2C(=N1)N=N3)N.[Na+]
CAS RN: 5100-84-5
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MOLECULAR FORMULA: C20H11NO2
MOLECULAR WEIGHT: 297.30684
SMILES: C1=CC=C2C(=C1)C=CC3=CC4=C(C5=CC=CC=C5OC4=O)N=C32
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