CAS RN: 63538-26-1
CAS Name: 2-[2-chloro-4-[3-chloro-4-(1-ethoxy-1-oxooctan-2-yl)oxyphenoxy]phenoxy]octanoic acid ethyl ester
OPENEYE Name: ethyl 2-[2-chloro-4-[3-chloro-4-(1-ethoxycarbonylheptoxy)phenoxy]phenoxy]octanoate
IUPAC Name: ethyl 2-[2-chloro-4-[3-chloro-4-(1-ethoxy-1-oxooctan-2-yl)oxyphenoxy]phenoxy]octanoate
SYSTEMATIC NAME: ethyl 2-[2-chloranyl-4-[3-chloranyl-4-(1-ethoxy-1-oxidanylidene-octan-2-yl)oxy-phenoxy]phenoxy]octanoate
MOLECULAR FORMULA: C32H44Cl2O7
MOLECULAR WEIGHT: 611.59356
SMILES: CCCCCCC(C(=O)OCC)OC1=C(C=C(C=C1)OC2=CC(=C(C=C2)OC(CCCCCC)C(=O)OCC)Cl)Cl
Structure:
CAS RN: 63538-12-5
CAS Name: 2-[4-[[4-(1-carboxyheptoxy)phenyl]thio]phenoxy]octanoic acid
OPENEYE Name: 2-[4-[4-(1-carboxyheptoxy)phenyl]sulfanylphenoxy]octanoic acid
IUPAC Name: 2-[4-[4-(1-carboxyheptoxy)phenyl]sulfanylphenoxy]octanoic acid
SYSTEMATIC NAME: 2-[4-[4-(1-oxidanyl-1-oxidanylidene-octan-2-yl)oxyphenyl]sulfanylphenoxy]octanoic acid
MOLECULAR FORMULA: C28H38O6S
MOLECULAR WEIGHT: 502.66272
SMILES: CCCCCCC(C(=O)O)OC1=CC=C(C=C1)SC2=CC=C(C=C2)OC(CCCCCC)C(=O)O
Structure:
CAS RN: 63538-11-4
CAS Name: 2-[4-[[4-(1-ethoxy-1-oxooctan-2-yl)oxyphenyl]thio]phenoxy]octanoic acid ethyl ester
OPENEYE Name: ethyl 2-[4-[4-(1-ethoxycarbonylheptoxy)phenyl]sulfanylphenoxy]octanoate
IUPAC Name: ethyl 2-[4-[4-(1-ethoxy-1-oxooctan-2-yl)oxyphenyl]sulfanylphenoxy]octanoate
SYSTEMATIC NAME: ethyl 2-[4-[4-(1-ethoxy-1-oxidanylidene-octan-2-yl)oxyphenyl]sulfanylphenoxy]octanoate
MOLECULAR FORMULA: C32H46O6S
MOLECULAR WEIGHT: 558.76904
SMILES: CCCCCCC(C(=O)OCC)OC1=CC=C(C=C1)SC2=CC=C(C=C2)OC(CCCCCC)C(=O)OCC
Structure:
CAS RN: 63515-46-8
CAS Name: 1,2,3,5,6,7-hexahydro-s-indacen-1-amine hydrochloride
OPENEYE Name: 1,2,3,5,6,7-hexahydro-s-indacen-1-amine hydrochloride
IUPAC Name: 1,2,3,5,6,7-hexahydro-s-indacen-1-amine hydrochloride
SYSTEMATIC NAME: 1,2,3,5,6,7-hexahydro-s-indacen-1-amine hydrochloride
MOLECULAR FORMULA: C12H16ClN
MOLECULAR WEIGHT: 209.71514
SMILES: C1CC2=CC3=C(C=C2C1)C(CC3)N.Cl
Structure:
CAS RN: 63515-45-7
CAS Name: 2-(3,3-diphenylpropyl)-1,3,4,6,7,8-hexahydrocyclopenta[g]isoquinoline hydrochloride
OPENEYE Name: 2-(3,3-diphenylpropyl)-1,3,4,6,7,8-hexahydrocyclopenta[g]isoquinoline hydrochloride
IUPAC Name: 2-(3,3-diphenylpropyl)-1,3,4,6,7,8-hexahydrocyclopenta[g]isoquinoline hydrochloride
SYSTEMATIC NAME: 2-(3,3-diphenylpropyl)-1,3,4,6,7,8-hexahydrocyclopenta[g]isoquinoline hydrochloride
MOLECULAR FORMULA: C27H30ClN
MOLECULAR WEIGHT: 403.9868
SMILES: C1CC2=CC3=C(CN(CC3)CCC(C4=CC=CC=C4)C5=CC=CC=C5)C=C2C1.Cl
Structure:
CAS RN: 63515-43-5
CAS Name: 2-[2-(3,4-dimethoxyphenyl)ethyl]-1,3,4,6,7,8-hexahydrocyclopenta[g]isoquinoline hydrochloride
OPENEYE Name: 2-[2-(3,4-dimethoxyphenyl)ethyl]-1,3,4,6,7,8-hexahydrocyclopenta[g]isoquinoline hydrochloride
IUPAC Name: 2-[2-(3,4-dimethoxyphenyl)ethyl]-1,3,4,6,7,8-hexahydrocyclopenta[g]isoquinoline hydrochloride
SYSTEMATIC NAME: 2-[2-(3,4-dimethoxyphenyl)ethyl]-1,3,4,6,7,8-hexahydrocyclopenta[g]isoquinoline hydrochloride
MOLECULAR FORMULA: C22H28ClNO2
MOLECULAR WEIGHT: 373.91622
SMILES: COC1=C(C=C(C=C1)CCN2CCC3=C(C2)C=C4CCCC4=C3)OC.Cl
Structure:
CAS RN: 63515-41-3
CAS Name: 2-(2-phenylethyl)-1,3,4,6,7,8-hexahydrocyclopenta[g]isoquinoline hydrochloride
OPENEYE Name: 2-(2-phenylethyl)-1,3,4,6,7,8-hexahydrocyclopenta[g]isoquinoline hydrochloride
IUPAC Name: 2-(2-phenylethyl)-1,3,4,6,7,8-hexahydrocyclopenta[g]isoquinoline hydrochloride
SYSTEMATIC NAME: 2-(2-phenylethyl)-1,3,4,6,7,8-hexahydrocyclopenta[g]isoquinoline hydrochloride
MOLECULAR FORMULA: C20H24ClN
MOLECULAR WEIGHT: 313.86426
SMILES: C1CC2=CC3=C(CN(CC3)CCC4=CC=CC=C4)C=C2C1.Cl
Structure:
CAS RN: 63515-36-6
CAS Name: 2-methyl-1,3,4,6,7,8-hexahydrocyclopenta[g]isoquinoline hydrochloride
OPENEYE Name: 2-methyl-1,3,4,6,7,8-hexahydrocyclopenta[g]isoquinoline hydrochloride
IUPAC Name: 2-methyl-1,3,4,6,7,8-hexahydrocyclopenta[g]isoquinoline hydrochloride
SYSTEMATIC NAME: 2-methyl-1,3,4,6,7,8-hexahydrocyclopenta[g]isoquinoline hydrochloride
MOLECULAR FORMULA: C13H18ClN
MOLECULAR WEIGHT: 223.74172
SMILES: CN1CCC2=C(C1)C=C3CCCC3=C2.Cl
Structure:
CAS RN: 63515-31-1
CAS Name: 2,3,4,6,7,8-hexahydro-1H-cyclopenta[g]isoquinoline hydrochloride
OPENEYE Name: 2,3,4,6,7,8-hexahydro-1H-cyclopenta[g]isoquinoline hydrochloride
IUPAC Name: 2,3,4,6,7,8-hexahydro-1H-cyclopenta[g]isoquinoline hydrochloride
SYSTEMATIC NAME: 2,3,4,6,7,8-hexahydro-1H-cyclopenta[g]isoquinoline hydrochloride
MOLECULAR FORMULA: C12H16ClN
MOLECULAR WEIGHT: 209.71514
SMILES: C1CC2=CC3=C(CNCC3)C=C2C1.Cl
Structure:
CAS RN: 63504-05-2
CAS Name: (2R,5R,6R)-6-[[2-amino-1-oxo-2-(3-thiophenyl)ethyl]amino]-3-methylene-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
OPENEYE Name: (2R,5R,6R)-6-[[2-amino-2-(3-thienyl)acetyl]amino]-3-methylene-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
IUPAC Name: (2R,5R,6R)-6-[(2-amino-2-thiophen-3-ylacetyl)amino]-3-methylidene-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
SYSTEMATIC NAME: (2R,5R,6R)-6-[(2-azanyl-2-thiophen-3-yl-ethanoyl)amino]-3-methylidene-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
MOLECULAR FORMULA: C13H13N3O4S2
MOLECULAR WEIGHT: 339.39002
SMILES: C=C1[C@H](N2[C@H](S1)[C@@H](C2=O)NC(=O)C(C3=CSC=C3)N)C(=O)O
Structure:
CAS RN: 63503-57-1
CAS Name: 5-imino-4-methyl-1,3,4-thiadiazol-2-amine hydroiodide
OPENEYE Name: 5-imino-4-methyl-1,3,4-thiadiazol-2-amine hydroiodide
IUPAC Name: 5-imino-4-methyl-1,3,4-thiadiazol-2-amine hydroiodide
SYSTEMATIC NAME: 5-azanylidene-4-methyl-1,3,4-thiadiazol-2-amine hydroiodide
MOLECULAR FORMULA: C3H7IN4S
MOLECULAR WEIGHT: 258.08395
SMILES: CN1C(=N)SC(=N1)N.I
Structure:
CAS RN: 63503-51-5
CAS Name: 5-(methylamino)-3H-1,3,4-thiadiazole-2-thione hydrochloride
OPENEYE Name: 5-(methylamino)-3H-1,3,4-thiadiazole-2-thione hydrochloride
IUPAC Name: 5-(methylamino)-3H-1,3,4-thiadiazole-2-thione hydrochloride
SYSTEMATIC NAME: 5-(methylamino)-3H-1,3,4-thiadiazole-2-thione hydrochloride
MOLECULAR FORMULA: C3H6ClN3S2
MOLECULAR WEIGHT: 183.68284
SMILES: CNC1=NNC(=S)S1.Cl
Structure:
CAS RN: 63503-50-4
CAS Name: 5-(4-morpholinyl)-3H-1,3,4-thiadiazole-2-thione hydrochloride
OPENEYE Name: 5-morpholino-3H-1,3,4-thiadiazole-2-thione hydrochloride
IUPAC Name: 5-morpholin-4-yl-3H-1,3,4-thiadiazole-2-thione hydrochloride
SYSTEMATIC NAME: 5-morpholin-4-yl-3H-1,3,4-thiadiazole-2-thione hydrochloride
MOLECULAR FORMULA: C6H10ClN3OS2
MOLECULAR WEIGHT: 239.7461
SMILES: C1COCCN1C2=NNC(=S)S2.Cl
Structure:
CAS RN: 2810-66-4
CAS Name: 5-(dimethylamino)-3H-1,3,4-thiadiazole-2-thione
OPENEYE Name: 5-(dimethylamino)-3H-1,3,4-thiadiazole-2-thione
IUPAC Name: 5-(dimethylamino)-3H-1,3,4-thiadiazole-2-thione
SYSTEMATIC NAME: 5-(dimethylamino)-3H-1,3,4-thiadiazole-2-thione
MOLECULAR FORMULA: C4H7N3S2
MOLECULAR WEIGHT: 161.24848
SMILES: CN(C)C1=NNC(=S)S1
Structure:
CAS RN: 63503-49-1
CAS Name: 5-(dimethylamino)-3H-1,3,4-thiadiazole-2-thione hydrochloride
OPENEYE Name: 5-(dimethylamino)-3H-1,3,4-thiadiazole-2-thione hydrochloride
IUPAC Name: 5-(dimethylamino)-3H-1,3,4-thiadiazole-2-thione hydrochloride
SYSTEMATIC NAME: 5-(dimethylamino)-3H-1,3,4-thiadiazole-2-thione hydrochloride
MOLECULAR FORMULA: C4H8ClN3S2
MOLECULAR WEIGHT: 197.70942
SMILES: CN(C)C1=NNC(=S)S1.Cl
Structure:
CAS RN: 63503-47-9
CAS Name: N,N,5-trimethyl-1,3,4-thiadiazol-2-amine hydrochloride
OPENEYE Name: N,N,5-trimethyl-1,3,4-thiadiazol-2-amine hydrochloride
IUPAC Name: N,N,5-trimethyl-1,3,4-thiadiazol-2-amine hydrochloride
SYSTEMATIC NAME: N,N,5-trimethyl-1,3,4-thiadiazol-2-amine hydrochloride
MOLECULAR FORMULA: C5H10ClN3S
MOLECULAR WEIGHT: 179.671
SMILES: CC1=NN=C(S1)N(C)C.Cl
Structure:
CAS RN: 63503-46-8
CAS Name: 4-(1,3,4-thiadiazol-2-yl)morpholine hydrochloride
OPENEYE Name: 4-(1,3,4-thiadiazol-2-yl)morpholine hydrochloride
IUPAC Name: 4-(1,3,4-thiadiazol-2-yl)morpholine hydrochloride
SYSTEMATIC NAME: 4-(1,3,4-thiadiazol-2-yl)morpholine hydrochloride
MOLECULAR FORMULA: C6H10ClN3OS
MOLECULAR WEIGHT: 207.6811
SMILES: C1COCCN1C2=NN=CS2.Cl
Structure:
CAS RN: 63503-45-7
CAS Name: N,N-dimethyl-1,3,4-thiadiazol-2-amine hydrobromide
OPENEYE Name: N,N-dimethyl-1,3,4-thiadiazol-2-amine hydrobromide
IUPAC Name: N,N-dimethyl-1,3,4-thiadiazol-2-amine hydrobromide
SYSTEMATIC NAME: N,N-dimethyl-1,3,4-thiadiazol-2-amine hydrobromide
MOLECULAR FORMULA: C4H8BrN3S
MOLECULAR WEIGHT: 210.09542
SMILES: CN(C)C1=NN=CS1.Br
Structure:
CAS RN: 63498-62-4
CAS Name: 1,2,3,5-tetrachloro-4-(dichloromethyl)-6-methylbenzene
OPENEYE Name: 1,2,3,5-tetrachloro-4-(dichloromethyl)-6-methyl-benzene
IUPAC Name: 1,2,3,5-tetrachloro-4-(dichloromethyl)-6-methylbenzene
SYSTEMATIC NAME: 1-[bis(chloranyl)methyl]-2,3,4,6-tetrakis(chloranyl)-5-methyl-benzene
MOLECULAR FORMULA: C8H4Cl6
MOLECULAR WEIGHT: 312.83536
SMILES: CC1=C(C(=C(C(=C1Cl)Cl)Cl)C(Cl)Cl)Cl
Structure:
CAS RN: 63495-22-7
CAS Name: 3,7-dimethyl-5-(3,3,3-trifluoropropyl)-4,6,11-trioxa-1-aza-5-silabicyclo[3.3.3]undecane
OPENEYE Name: 3,7-dimethyl-5-(3,3,3-trifluoropropyl)-4,6,11-trioxa-1-aza-5-silabicyclo[3.3.3]undecane
IUPAC Name: 3,7-dimethyl-5-(3,3,3-trifluoropropyl)-4,6,11-trioxa-1-aza-5-silabicyclo[3.3.3]undecane
SYSTEMATIC NAME: 3,7-dimethyl-5-[3,3,3-tris(fluoranyl)propyl]-4,6,11-trioxa-1-aza-5-silabicyclo[3.3.3]undecane
MOLECULAR FORMULA: C11H20F3NO3Si
MOLECULAR WEIGHT: 299.36211
SMILES: CC1CN2CCO[Si](O1)(OC(C2)C)CCC(F)(F)F
Structure:
CAS RN: 63490-88-0
CAS Name: benzoic acid [1-cyclopentyl-2-[(1-methyl-4-piperidinyl)oxy]-2-oxo-1-phenylethyl] ester hydrochloride
OPENEYE Name: [1-cyclopentyl-2-[(1-methyl-4-piperidyl)oxy]-2-oxo-1-phenyl-ethyl] benzoate hydrochloride
IUPAC Name: [1-cyclopentyl-2-(1-methylpiperidin-4-yl)oxy-2-oxo-1-phenylethyl] benzoate hydrochloride
SYSTEMATIC NAME: [1-cyclopentyl-2-(1-methylpiperidin-4-yl)oxy-2-oxidanylidene-1-phenyl-ethyl] benzoate hydrochloride
MOLECULAR FORMULA: C26H32ClNO4
MOLECULAR WEIGHT: 457.98958
SMILES: CN1CCC(CC1)OC(=O)C(C2CCCC2)(C3=CC=CC=C3)OC(=O)C4=CC=CC=C4.Cl
Structure:
CAS RN: 63453-66-7
CAS Name: 3-methyl-5-(3,3,3-trifluoropropyl)-4,6,11-trioxa-1-aza-5-silabicyclo[3.3.3]undecane
OPENEYE Name: 3-methyl-5-(3,3,3-trifluoropropyl)-4,6,11-trioxa-1-aza-5-silabicyclo[3.3.3]undecane
IUPAC Name: 3-methyl-5-(3,3,3-trifluoropropyl)-4,6,11-trioxa-1-aza-5-silabicyclo[3.3.3]undecane
SYSTEMATIC NAME: 3-methyl-5-[3,3,3-tris(fluoranyl)propyl]-4,6,11-trioxa-1-aza-5-silabicyclo[3.3.3]undecane
MOLECULAR FORMULA: C10H18F3NO3Si
MOLECULAR WEIGHT: 285.33553
SMILES: CC1CN2CCO[Si](O1)(OCC2)CCC(F)(F)F
Structure:
CAS RN: 63451-72-9
CAS Name: 1-(3-chloro-8-methoxy-5,6-dihydrobenzo[b][1]benzothiepin-6-yl)-4-methylpiperazine dihydrochloride
OPENEYE Name: 1-(3-chloro-8-methoxy-5,6-dihydrobenzo[b][1]benzothiepin-6-yl)-4-methyl-piperazine dihydrochloride
IUPAC Name: 1-(3-chloro-8-methoxy-5,6-dihydrobenzo[b][1]benzothiepin-6-yl)-4-methylpiperazine dihydrochloride
SYSTEMATIC NAME: 1-(3-chloranyl-8-methoxy-5,6-dihydrobenzo[b][1]benzothiepin-6-yl)-4-methyl-piperazine dihydrochloride
MOLECULAR FORMULA: C20H25Cl3N2OS
MOLECULAR WEIGHT: 447.8493
SMILES: CN1CCN(CC1)C2CC3=C(C=CC(=C3)Cl)SC4=C2C=C(C=C4)OC.Cl.Cl
Structure:
CAS RN: 63445-69-2
CAS Name: (2R,4aR,8aR)-2-methyl-1-(3-phenylprop-2-ynyl)-2,3,4a,5,6,7,8,8a-octahydroquinolin-4-one hydrochloride
OPENEYE Name: (2R,4aR,8aR)-2-methyl-1-(3-phenylprop-2-ynyl)-2,3,4a,5,6,7,8,8a-octahydroquinolin-4-one hydrochloride
IUPAC Name: (2R,4aR,8aR)-2-methyl-1-(3-phenylprop-2-ynyl)-2,3,4a,5,6,7,8,8a-octahydroquinolin-4-one hydrochloride
SYSTEMATIC NAME: (2R,4aR,8aR)-2-methyl-1-(3-phenylprop-2-ynyl)-2,3,4a,5,6,7,8,8a-octahydroquinolin-4-one hydrochloride
MOLECULAR FORMULA: C19H24ClNO
MOLECULAR WEIGHT: 317.85296
SMILES: C[C@@H]1CC(=O)[C@@H]2CCCC[C@H]2N1CC#CC3=CC=CC=C3.Cl
Structure:
CAS RN: 63445-67-0
CAS Name: 3-methyl-2-phenyl-1-(3-phenylprop-2-ynyl)-4-piperidinone hydrochloride
OPENEYE Name: 3-methyl-2-phenyl-1-(3-phenylprop-2-ynyl)piperidin-4-one hydrochloride
IUPAC Name: 3-methyl-2-phenyl-1-(3-phenylprop-2-ynyl)piperidin-4-one hydrochloride
SYSTEMATIC NAME: 3-methyl-2-phenyl-1-(3-phenylprop-2-ynyl)piperidin-4-one hydrochloride
MOLECULAR FORMULA: C21H22ClNO
MOLECULAR WEIGHT: 339.85848
SMILES: CC1C(N(CCC1=O)CC#CC2=CC=CC=C2)C3=CC=CC=C3.Cl
Structure:
CAS RN: 63445-63-6
CAS Name: 2,5-dimethyl-1-(3-phenylprop-2-ynyl)-4-piperidinone hydrochloride
OPENEYE Name: 2,5-dimethyl-1-(3-phenylprop-2-ynyl)piperidin-4-one hydrochloride
IUPAC Name: 2,5-dimethyl-1-(3-phenylprop-2-ynyl)piperidin-4-one hydrochloride
SYSTEMATIC NAME: 2,5-dimethyl-1-(3-phenylprop-2-ynyl)piperidin-4-one hydrochloride
MOLECULAR FORMULA: C16H20ClNO
MOLECULAR WEIGHT: 277.7891
SMILES: CC1CC(=O)C(CN1CC#CC2=CC=CC=C2)C.Cl
Structure:
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