CAS RN: 86560-16-9
CAS Name: 1-[(4-fluorophenyl)-hydroxymethyl]-2-methyl-4-oxaspiro[4.5]dec-1-en-3-one
OPENEYE Name: 1-[(4-fluorophenyl)-hydroxy-methyl]-2-methyl-4-oxaspiro[4.5]dec-1-en-3-one
IUPAC Name: 1-[(4-fluorophenyl)-hydroxymethyl]-2-methyl-4-oxaspiro[4.5]dec-1-en-3-one
SYSTEMATIC NAME: 1-[(4-fluorophenyl)-oxidanyl-methyl]-2-methyl-4-oxaspiro[4.5]dec-1-en-3-one
MOLECULAR FORMULA: C17H19FO3
MOLECULAR WEIGHT: 290.329363
SMILES: CC1=C(C2(CCCCC2)OC1=O)C(C3=CC=C(C=C3)F)O
Structure:
CAS RN: 86560-15-8
CAS Name: 1-[hydroxy(phenyl)methyl]-2-methyl-4-oxaspiro[4.5]dec-1-en-3-one
OPENEYE Name: 1-[hydroxy(phenyl)methyl]-2-methyl-4-oxaspiro[4.5]dec-1-en-3-one
IUPAC Name: 1-[hydroxy(phenyl)methyl]-2-methyl-4-oxaspiro[4.5]dec-1-en-3-one
SYSTEMATIC NAME: 2-methyl-1-[oxidanyl(phenyl)methyl]-4-oxaspiro[4.5]dec-1-en-3-one
MOLECULAR FORMULA: C17H20O3
MOLECULAR WEIGHT: 272.3389
SMILES: CC1=C(C2(CCCCC2)OC1=O)C(C3=CC=CC=C3)O
Structure:
CAS RN: 86560-14-7
CAS Name: 1-[(4-hydroxy-3,5-dimethylphenyl)-oxomethyl]-2-methyl-4-oxaspiro[4.5]dec-1-en-3-one
OPENEYE Name: 1-(4-hydroxy-3,5-dimethyl-benzoyl)-2-methyl-4-oxaspiro[4.5]dec-1-en-3-one
IUPAC Name: 1-(4-hydroxy-3,5-dimethylbenzoyl)-2-methyl-4-oxaspiro[4.5]dec-1-en-3-one
SYSTEMATIC NAME: 1-(3,5-dimethyl-4-oxidanyl-phenyl)carbonyl-2-methyl-4-oxaspiro[4.5]dec-1-en-3-one
MOLECULAR FORMULA: C19H22O4
MOLECULAR WEIGHT: 314.37558
SMILES: CC1=CC(=CC(=C1O)C)C(=O)C2=C(C(=O)OC23CCCCC3)C
Structure:
CAS RN: 86560-13-6
CAS Name: 2-methyl-1-[oxo-(2,4,5-trimethylphenyl)methyl]-4-oxaspiro[4.5]dec-1-en-3-one
OPENEYE Name: 2-methyl-1-(2,4,5-trimethylbenzoyl)-4-oxaspiro[4.5]dec-1-en-3-one
IUPAC Name: 2-methyl-1-(2,4,5-trimethylbenzoyl)-4-oxaspiro[4.5]dec-1-en-3-one
SYSTEMATIC NAME: 2-methyl-1-(2,4,5-trimethylphenyl)carbonyl-4-oxaspiro[4.5]dec-1-en-3-one
MOLECULAR FORMULA: C20H24O3
MOLECULAR WEIGHT: 312.40276
SMILES: CC1=CC(=C(C=C1C(=O)C2=C(C(=O)OC23CCCCC3)C)C)C
Structure:
CAS RN: 86560-12-5
CAS Name: 2-methyl-1-[(2-methylphenyl)-oxomethyl]-4-oxaspiro[4.5]dec-1-en-3-one
OPENEYE Name: 2-methyl-1-(2-methylbenzoyl)-4-oxaspiro[4.5]dec-1-en-3-one
IUPAC Name: 2-methyl-1-(2-methylbenzoyl)-4-oxaspiro[4.5]dec-1-en-3-one
SYSTEMATIC NAME: 2-methyl-1-(2-methylphenyl)carbonyl-4-oxaspiro[4.5]dec-1-en-3-one
MOLECULAR FORMULA: C18H20O3
MOLECULAR WEIGHT: 284.3496
SMILES: CC1=CC=CC=C1C(=O)C2=C(C(=O)OC23CCCCC3)C
Structure:
CAS RN: 86560-11-4
CAS Name: 2-methyl-1-[(4-methylphenyl)-oxomethyl]-4-oxaspiro[4.5]dec-1-en-3-one
OPENEYE Name: 2-methyl-1-(4-methylbenzoyl)-4-oxaspiro[4.5]dec-1-en-3-one
IUPAC Name: 2-methyl-1-(4-methylbenzoyl)-4-oxaspiro[4.5]dec-1-en-3-one
SYSTEMATIC NAME: 2-methyl-1-(4-methylphenyl)carbonyl-4-oxaspiro[4.5]dec-1-en-3-one
MOLECULAR FORMULA: C18H20O3
MOLECULAR WEIGHT: 284.3496
SMILES: CC1=CC=C(C=C1)C(=O)C2=C(C(=O)OC23CCCCC3)C
Structure:
CAS RN: 86560-10-3
CAS Name: 1-[(4-bromophenyl)-oxomethyl]-2-methyl-4-oxaspiro[4.5]dec-1-en-3-one
OPENEYE Name: 1-(4-bromobenzoyl)-2-methyl-4-oxaspiro[4.5]dec-1-en-3-one
IUPAC Name: 1-(4-bromobenzoyl)-2-methyl-4-oxaspiro[4.5]dec-1-en-3-one
SYSTEMATIC NAME: 1-(4-bromophenyl)carbonyl-2-methyl-4-oxaspiro[4.5]dec-1-en-3-one
MOLECULAR FORMULA: C17H17BrO3
MOLECULAR WEIGHT: 349.21908
SMILES: CC1=C(C2(CCCCC2)OC1=O)C(=O)C3=CC=C(C=C3)Br
Structure:
CAS RN: 86560-09-0
CAS Name: 1-[(2-chlorophenyl)-oxomethyl]-2-methyl-4-oxaspiro[4.5]dec-1-en-3-one
OPENEYE Name: 1-(2-chlorobenzoyl)-2-methyl-4-oxaspiro[4.5]dec-1-en-3-one
IUPAC Name: 1-(2-chlorobenzoyl)-2-methyl-4-oxaspiro[4.5]dec-1-en-3-one
SYSTEMATIC NAME: 1-(2-chlorophenyl)carbonyl-2-methyl-4-oxaspiro[4.5]dec-1-en-3-one
MOLECULAR FORMULA: C17H17ClO3
MOLECULAR WEIGHT: 304.76808
SMILES: CC1=C(C2(CCCCC2)OC1=O)C(=O)C3=CC=CC=C3Cl
Structure:
CAS RN: 86560-08-9
CAS Name: 1-[(4-chlorophenyl)-oxomethyl]-2-methyl-4-oxaspiro[4.5]dec-1-en-3-one
OPENEYE Name: 1-(4-chlorobenzoyl)-2-methyl-4-oxaspiro[4.5]dec-1-en-3-one
IUPAC Name: 1-(4-chlorobenzoyl)-2-methyl-4-oxaspiro[4.5]dec-1-en-3-one
SYSTEMATIC NAME: 1-(4-chlorophenyl)carbonyl-2-methyl-4-oxaspiro[4.5]dec-1-en-3-one
MOLECULAR FORMULA: C17H17ClO3
MOLECULAR WEIGHT: 304.76808
SMILES: CC1=C(C2(CCCCC2)OC1=O)C(=O)C3=CC=C(C=C3)Cl
Structure:
CAS RN: 86560-07-8
CAS Name: 1-[(4-fluorophenyl)-oxomethyl]-2-methyl-4-oxaspiro[4.5]dec-1-en-3-one
OPENEYE Name: 1-(4-fluorobenzoyl)-2-methyl-4-oxaspiro[4.5]dec-1-en-3-one
IUPAC Name: 1-(4-fluorobenzoyl)-2-methyl-4-oxaspiro[4.5]dec-1-en-3-one
SYSTEMATIC NAME: 1-(4-fluorophenyl)carbonyl-2-methyl-4-oxaspiro[4.5]dec-1-en-3-one
MOLECULAR FORMULA: C17H17FO3
MOLECULAR WEIGHT: 288.313483
SMILES: CC1=C(C2(CCCCC2)OC1=O)C(=O)C3=CC=C(C=C3)F
Structure:
CAS RN: 86553-26-6
CAS Name: N-[7-(3,6-dihydro-2H-pyridin-1-yl)-2-oxo-[1,2,4]oxadiazolo[2,3-c]pyrimidin-5-yl]carbamic acid 2-methylpropyl ester
OPENEYE Name: isobutyl N-[7-(3,6-dihydro-2H-pyridin-1-yl)-2-oxo-[1,2,4]oxadiazolo[2,3-c]pyrimidin-5-yl]carbamate
IUPAC Name: 2-methylpropyl N-[7-(3,6-dihydro-2H-pyridin-1-yl)-2-oxo-[1,2,4]oxadiazolo[2,3-c]pyrimidin-5-yl]carbamate
SYSTEMATIC NAME: 2-methylpropyl N-[7-(3,6-dihydro-2H-pyridin-1-yl)-2-oxidanylidene-[1,2,4]oxadiazolo[2,3-c]pyrimidin-5-yl]carbamate
MOLECULAR FORMULA: C15H19N5O4
MOLECULAR WEIGHT: 333.34246
SMILES: CC(C)COC(=O)NC1=NC(=CC2=NC(=O)ON21)N3CCC=CC3
Structure:
CAS RN: 86548-94-9
CAS Name: 2,4-bis(2-oxiranylmethyl)-1,2,4-triazol-3-one
OPENEYE Name: 2,4-bis(oxiran-2-ylmethyl)-1,2,4-triazol-3-one
IUPAC Name: 2,4-bis(oxiran-2-ylmethyl)-1,2,4-triazol-3-one
SYSTEMATIC NAME: 2,4-bis(oxiran-2-ylmethyl)-1,2,4-triazol-3-one
MOLECULAR FORMULA: C8H11N3O3
MOLECULAR WEIGHT: 197.19124
SMILES: C1C(O1)CN2C=NN(C2=O)CC3CO3
Structure:
CAS RN: 86542-80-5
CAS Name: 3-(2,4-dichlorophenyl)-2-methyl-4-pyrido[3,2-d]pyrimidinone
OPENEYE Name: 3-(2,4-dichlorophenyl)-2-methyl-pyrido[3,2-d]pyrimidin-4-one
IUPAC Name: 3-(2,4-dichlorophenyl)-2-methylpyrido[3,2-d]pyrimidin-4-one
SYSTEMATIC NAME: 3-(2,4-dichlorophenyl)-2-methyl-pyrido[3,2-d]pyrimidin-4-one
MOLECULAR FORMULA: C14H9Cl2N3O
MOLECULAR WEIGHT: 306.14676
SMILES: CC1=NC2=C(C(=O)N1C3=C(C=C(C=C3)Cl)Cl)N=CC=C2
Structure:
CAS RN: 86542-78-1
CAS Name: 2,6,7-trimethyl-4-oxo-3-(2-pyridinyl)-8-quinazolinecarboxylic acid
OPENEYE Name: 2,6,7-trimethyl-4-oxo-3-(2-pyridyl)quinazoline-8-carboxylic acid
IUPAC Name: 2,6,7-trimethyl-4-oxo-3-pyridin-2-ylquinazoline-8-carboxylic acid
SYSTEMATIC NAME: 2,6,7-trimethyl-4-oxidanylidene-3-pyridin-2-yl-quinazoline-8-carboxylic acid
MOLECULAR FORMULA: C17H15N3O3
MOLECULAR WEIGHT: 309.3193
SMILES: CC1=C(C(=C2C(=C1)C(=O)N(C(=N2)C)C3=CC=CC=N3)C(=O)O)C
Structure:
CAS RN: 86525-76-0
CAS Name: 1-[2-(3,4-dimethoxyphenyl)ethylamino]-3-[(5-methyl-3-thiophenyl)oxy]-2-propanol
OPENEYE Name: 1-[2-(3,4-dimethoxyphenyl)ethylamino]-3-[(5-methyl-3-thienyl)oxy]propan-2-ol
IUPAC Name: 1-[2-(3,4-dimethoxyphenyl)ethylamino]-3-(5-methylthiophen-3-yl)oxypropan-2-ol
SYSTEMATIC NAME: 1-[2-(3,4-dimethoxyphenyl)ethylamino]-3-(5-methylthiophen-3-yl)oxy-propan-2-ol
MOLECULAR FORMULA: C18H25NO4S
MOLECULAR WEIGHT: 351.4604
SMILES: CC1=CC(=CS1)OCC(CNCCC2=CC(=C(C=C2)OC)OC)O
Structure:
CAS RN: 86525-75-9
CAS Name: 1-(tert-butylamino)-3-[(5-methyl-3-thiophenyl)oxy]-2-propanol
OPENEYE Name: 1-(tert-butylamino)-3-[(5-methyl-3-thienyl)oxy]propan-2-ol
IUPAC Name: 1-(tert-butylamino)-3-(5-methylthiophen-3-yl)oxypropan-2-ol
SYSTEMATIC NAME: 1-(tert-butylamino)-3-(5-methylthiophen-3-yl)oxy-propan-2-ol
MOLECULAR FORMULA: C12H21NO2S
MOLECULAR WEIGHT: 243.36564
SMILES: CC1=CC(=CS1)OCC(CNC(C)(C)C)O
Structure:
CAS RN: 86525-74-8
CAS Name: 1-[(5-methyl-3-thiophenyl)oxy]-3-(propan-2-ylamino)-2-propanol
OPENEYE Name: 1-(isopropylamino)-3-[(5-methyl-3-thienyl)oxy]propan-2-ol
IUPAC Name: 1-(5-methylthiophen-3-yl)oxy-3-(propan-2-ylamino)propan-2-ol
SYSTEMATIC NAME: 1-(5-methylthiophen-3-yl)oxy-3-(propan-2-ylamino)propan-2-ol
MOLECULAR FORMULA: C11H19NO2S
MOLECULAR WEIGHT: 229.33906
SMILES: CC1=CC(=CS1)OCC(CNC(C)C)O
Structure:
CAS RN: 86525-24-8
CAS Name: 6-[(4-methyl-1-piperazinyl)-oxomethyl]-4-oxo-2-pyrancarboxylic acid ethyl ester hydrochloride
OPENEYE Name: ethyl 6-(4-methylpiperazine-1-carbonyl)-4-oxo-pyran-2-carboxylate hydrochloride
IUPAC Name: ethyl 6-(4-methylpiperazine-1-carbonyl)-4-oxopyran-2-carboxylate hydrochloride
SYSTEMATIC NAME: ethyl 6-(4-methylpiperazin-1-yl)carbonyl-4-oxidanylidene-pyran-2-carboxylate hydrochloride
MOLECULAR FORMULA: C14H19ClN2O5
MOLECULAR WEIGHT: 330.76406
SMILES: CCOC(=O)C1=CC(=O)C=C(O1)C(=O)N2CCN(CC2)C.Cl
Structure:
CAS RN: 86525-23-7
CAS Name: 5-hydroxy-6-(4-methyl-1-piperazinyl)-4-oxo-2-pyrancarboxylic acid hydrochloride
OPENEYE Name: 5-hydroxy-6-(4-methylpiperazin-1-yl)-4-oxo-pyran-2-carboxylic acid hydrochloride
IUPAC Name: 5-hydroxy-6-(4-methylpiperazin-1-yl)-4-oxopyran-2-carboxylic acid hydrochloride
SYSTEMATIC NAME: 6-(4-methylpiperazin-1-yl)-5-oxidanyl-4-oxidanylidene-pyran-2-carboxylic acid hydrochloride
MOLECULAR FORMULA: C11H15ClN2O5
MOLECULAR WEIGHT: 290.7002
SMILES: CN1CCN(CC1)C2=C(C(=O)C=C(O2)C(=O)O)O.Cl
Structure:
CAS RN: 86525-20-4
CAS Name: 6-(dibutylamino)-5-hydroxy-4-oxo-2-pyrancarboxylic acid
OPENEYE Name: 6-(dibutylamino)-5-hydroxy-4-oxo-pyran-2-carboxylic acid
IUPAC Name: 6-(dibutylamino)-5-hydroxy-4-oxopyran-2-carboxylic acid
SYSTEMATIC NAME: 6-(dibutylamino)-5-oxidanyl-4-oxidanylidene-pyran-2-carboxylic acid
MOLECULAR FORMULA: C14H21NO5
MOLECULAR WEIGHT: 283.32024
SMILES: CCCCN(CCCC)C1=C(C(=O)C=C(O1)C(=O)O)O
Structure:
CAS RN: 86525-19-1
CAS Name: 6-(dipropylamino)-5-hydroxy-4-oxo-2-pyrancarboxylic acid
OPENEYE Name: 6-(dipropylamino)-5-hydroxy-4-oxo-pyran-2-carboxylic acid
IUPAC Name: 6-(dipropylamino)-5-hydroxy-4-oxopyran-2-carboxylic acid
SYSTEMATIC NAME: 6-(dipropylamino)-5-oxidanyl-4-oxidanylidene-pyran-2-carboxylic acid
MOLECULAR FORMULA: C12H17NO5
MOLECULAR WEIGHT: 255.26708
SMILES: CCCN(CCC)C1=C(C(=O)C=C(O1)C(=O)O)O
Structure:
CAS RN: 86524-09-6
CAS Name: N-[4-(methylthio)phenyl]-3-[4-(2-pyridinyl)-1-piperazinyl]propanamide
OPENEYE Name: N-(4-methylsulfanylphenyl)-3-[4-(2-pyridyl)piperazin-1-yl]propanamide
IUPAC Name: N-(4-methylsulfanylphenyl)-3-(4-pyridin-2-ylpiperazin-1-yl)propanamide
SYSTEMATIC NAME: N-(4-methylsulfanylphenyl)-3-(4-pyridin-2-ylpiperazin-1-yl)propanamide
MOLECULAR FORMULA: C19H24N4OS
MOLECULAR WEIGHT: 356.48506
SMILES: CSC1=CC=C(C=C1)NC(=O)CCN2CCN(CC2)C3=CC=CC=N3
Structure:
CAS RN: 86523-91-3
CAS Name: N-(2-aminophenyl)-3-[4-(2-pyridinyl)-1-piperazinyl]propanamide
OPENEYE Name: N-(2-aminophenyl)-3-[4-(2-pyridyl)piperazin-1-yl]propanamide
IUPAC Name: N-(2-aminophenyl)-3-(4-pyridin-2-ylpiperazin-1-yl)propanamide
SYSTEMATIC NAME: N-(2-aminophenyl)-3-(4-pyridin-2-ylpiperazin-1-yl)propanamide
MOLECULAR FORMULA: C18H23N5O
MOLECULAR WEIGHT: 325.40812
SMILES: C1CN(CCN1CCC(=O)NC2=CC=CC=C2N)C3=CC=CC=N3
Structure:
CAS RN: 86523-85-5
CAS Name: N-phenyl-3-[4-(2-pyridinyl)-1-piperazinyl]propanamide
OPENEYE Name: N-phenyl-3-[4-(2-pyridyl)piperazin-1-yl]propanamide
IUPAC Name: N-phenyl-3-(4-pyridin-2-ylpiperazin-1-yl)propanamide
SYSTEMATIC NAME: N-phenyl-3-(4-pyridin-2-ylpiperazin-1-yl)propanamide
MOLECULAR FORMULA: C18H22N4O
MOLECULAR WEIGHT: 310.39348
SMILES: C1CN(CCN1CCC(=O)NC2=CC=CC=C2)C3=CC=CC=N3
Structure:
CAS RN: 86523-83-3
CAS Name: N-[4-(1-hydroxyethyl)phenyl]-3-[4-(2-pyridinyl)-1-piperazinyl]propanamide
OPENEYE Name: N-[4-(1-hydroxyethyl)phenyl]-3-[4-(2-pyridyl)piperazin-1-yl]propanamide
IUPAC Name: N-[4-(1-hydroxyethyl)phenyl]-3-(4-pyridin-2-ylpiperazin-1-yl)propanamide
SYSTEMATIC NAME: N-[4-(1-hydroxyethyl)phenyl]-3-(4-pyridin-2-ylpiperazin-1-yl)propanamide
MOLECULAR FORMULA: C20H26N4O2
MOLECULAR WEIGHT: 354.44604
SMILES: CC(C1=CC=C(C=C1)NC(=O)CCN2CCN(CC2)C3=CC=CC=N3)O
Structure:
CAS RN: 86523-81-1
CAS Name: 2-oxo-2-[4-[[1-oxo-3-[4-(2-pyridinyl)-1-piperazinyl]propyl]amino]anilino]acetic acid ethyl ester
OPENEYE Name: ethyl 2-oxo-2-[4-[3-[4-(2-pyridyl)piperazin-1-yl]propanoylamino]anilino]acetate
IUPAC Name: ethyl 2-oxo-2-[4-[3-(4-pyridin-2-ylpiperazin-1-yl)propanoylamino]anilino]acetate
SYSTEMATIC NAME: ethyl 2-oxidanylidene-2-[[4-[3-(4-pyridin-2-ylpiperazin-1-yl)propanoylamino]phenyl]amino]ethanoate
MOLECULAR FORMULA: C22H27N5O4
MOLECULAR WEIGHT: 425.48088
SMILES: CCOC(=O)C(=O)NC1=CC=C(C=C1)NC(=O)CCN2CCN(CC2)C3=CC=CC=N3
Structure:
CAS RN: 86523-79-7
CAS Name: N-[4-(carbamoylamino)phenyl]-3-[4-(2-pyridinyl)-1-piperazinyl]propanamide
OPENEYE Name: 3-[4-(2-pyridyl)piperazin-1-yl]-N-(4-ureidophenyl)propanamide
IUPAC Name: N-[4-(carbamoylamino)phenyl]-3-(4-pyridin-2-ylpiperazin-1-yl)propanamide
SYSTEMATIC NAME: N-[4-(aminocarbonylamino)phenyl]-3-(4-pyridin-2-ylpiperazin-1-yl)propanamide
MOLECULAR FORMULA: C19H24N6O2
MOLECULAR WEIGHT: 368.43286
SMILES: C1CN(CCN1CCC(=O)NC2=CC=C(C=C2)NC(=O)N)C3=CC=CC=N3
Structure:
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