CAS RN: 87367-87-1
CAS Name: 3-[4-[2-[4-(2,5-dioxo-3-pyrrolidinyl)phenoxy]ethoxy]phenyl]pyrrolidine-2,5-dione
OPENEYE Name: 3-[4-[2-[4-(2,5-dioxopyrrolidin-3-yl)phenoxy]ethoxy]phenyl]pyrrolidine-2,5-dione
IUPAC Name: 3-[4-[2-[4-(2,5-dioxopyrrolidin-3-yl)phenoxy]ethoxy]phenyl]pyrrolidine-2,5-dione
SYSTEMATIC NAME: 3-[4-[2-[4-[2,5-bis(oxidanylidene)pyrrolidin-3-yl]phenoxy]ethoxy]phenyl]pyrrolidine-2,5-dione
MOLECULAR FORMULA: C22H20N2O6
MOLECULAR WEIGHT: 408.404
SMILES: C1C(C(=O)NC1=O)C2=CC=C(C=C2)OCCOC3=CC=C(C=C3)C4CC(=O)NC4=O
Structure:
CAS RN: 87367-86-0
CAS Name: 3-[4-[[4-(2,5-dioxo-3-pyrrolidinyl)phenoxy]methoxy]phenyl]pyrrolidine-2,5-dione
OPENEYE Name: 3-[4-[[4-(2,5-dioxopyrrolidin-3-yl)phenoxy]methoxy]phenyl]pyrrolidine-2,5-dione
IUPAC Name: 3-[4-[[4-(2,5-dioxopyrrolidin-3-yl)phenoxy]methoxy]phenyl]pyrrolidine-2,5-dione
SYSTEMATIC NAME: 3-[4-[[4-[2,5-bis(oxidanylidene)pyrrolidin-3-yl]phenoxy]methoxy]phenyl]pyrrolidine-2,5-dione
MOLECULAR FORMULA: C21H18N2O6
MOLECULAR WEIGHT: 394.37742
SMILES: C1C(C(=O)NC1=O)C2=CC=C(C=C2)OCOC3=CC=C(C=C3)C4CC(=O)NC4=O
Structure:
CAS RN: 87359-08-8
CAS Name: 2-[4-(2-chlorophenyl)phenyl]propanoic acid [2-oxo-2-(4-phenyl-1-piperidinyl)ethyl] ester
OPENEYE Name: [2-oxo-2-(4-phenyl-1-piperidyl)ethyl] 2-[4-(2-chlorophenyl)phenyl]propanoate
IUPAC Name: [2-oxo-2-(4-phenylpiperidin-1-yl)ethyl] 2-[4-(2-chlorophenyl)phenyl]propanoate
SYSTEMATIC NAME: [2-oxidanylidene-2-(4-phenylpiperidin-1-yl)ethyl] 2-[4-(2-chlorophenyl)phenyl]propanoate
MOLECULAR FORMULA: C28H28ClNO3
MOLECULAR WEIGHT: 461.97982
SMILES: CC(C1=CC=C(C=C1)C2=CC=CC=C2Cl)C(=O)OCC(=O)N3CCC(CC3)C4=CC=CC=C4
Structure:
CAS RN: 87359-06-6
CAS Name: 2-[4-(2-chlorophenyl)phenyl]propanoic acid [2-(4-methyl-1-piperazinyl)-2-oxoethyl] ester hydrochloride
OPENEYE Name: [2-(4-methylpiperazin-1-yl)-2-oxo-ethyl] 2-[4-(2-chlorophenyl)phenyl]propanoate hydrochloride
IUPAC Name: [2-(4-methylpiperazin-1-yl)-2-oxoethyl] 2-[4-(2-chlorophenyl)phenyl]propanoate hydrochloride
SYSTEMATIC NAME: [2-(4-methylpiperazin-1-yl)-2-oxidanylidene-ethyl] 2-[4-(2-chlorophenyl)phenyl]propanoate hydrochloride
MOLECULAR FORMULA: C22H26Cl2N2O3
MOLECULAR WEIGHT: 437.35944
SMILES: CC(C1=CC=C(C=C1)C2=CC=CC=C2Cl)C(=O)OCC(=O)N3CCN(CC3)C.Cl
Structure:
CAS RN: 87356-73-8
CAS Name: 3-(2,6-dichlorophenyl)-2-methyl-6-phenyl-4-pyrimidinone
OPENEYE Name: 3-(2,6-dichlorophenyl)-2-methyl-6-phenyl-pyrimidin-4-one
IUPAC Name: 3-(2,6-dichlorophenyl)-2-methyl-6-phenylpyrimidin-4-one
SYSTEMATIC NAME: 3-[2,6-bis(chloranyl)phenyl]-2-methyl-6-phenyl-pyrimidin-4-one
MOLECULAR FORMULA: C17H12Cl2N2O
MOLECULAR WEIGHT: 331.19598
SMILES: CC1=NC(=CC(=O)N1C2=C(C=CC=C2Cl)Cl)C3=CC=CC=C3
Structure:
CAS RN: 87356-67-0
CAS Name: 3-(2-fluorophenyl)-2-methyl-6-phenyl-4-pyrimidinone
OPENEYE Name: 3-(2-fluorophenyl)-2-methyl-6-phenyl-pyrimidin-4-one
IUPAC Name: 3-(2-fluorophenyl)-2-methyl-6-phenylpyrimidin-4-one
SYSTEMATIC NAME: 3-(2-fluorophenyl)-2-methyl-6-phenyl-pyrimidin-4-one
MOLECULAR FORMULA: C17H13FN2O
MOLECULAR WEIGHT: 280.296323
SMILES: CC1=NC(=CC(=O)N1C2=CC=CC=C2F)C3=CC=CC=C3
Structure:
CAS RN: 87356-59-0
CAS Name: 3-(2,6-dichlorophenyl)-2-methyl-4-pyrimidinone
OPENEYE Name: 3-(2,6-dichlorophenyl)-2-methyl-pyrimidin-4-one
IUPAC Name: 3-(2,6-dichlorophenyl)-2-methylpyrimidin-4-one
SYSTEMATIC NAME: 3-[2,6-bis(chloranyl)phenyl]-2-methyl-pyrimidin-4-one
MOLECULAR FORMULA: C11H8Cl2N2O
MOLECULAR WEIGHT: 255.10002
SMILES: CC1=NC=CC(=O)N1C2=C(C=CC=C2Cl)Cl
Structure:
CAS RN: 87356-53-4
CAS Name: 3-(4-fluorophenyl)-2-methyl-4-pyrimidinone
OPENEYE Name: 3-(4-fluorophenyl)-2-methyl-pyrimidin-4-one
IUPAC Name: 3-(4-fluorophenyl)-2-methylpyrimidin-4-one
SYSTEMATIC NAME: 3-(4-fluorophenyl)-2-methyl-pyrimidin-4-one
MOLECULAR FORMULA: C11H9FN2O
MOLECULAR WEIGHT: 204.200363
SMILES: CC1=NC=CC(=O)N1C2=CC=C(C=C2)F
Structure:
CAS RN: 87356-51-2
CAS Name: 3-(2-fluorophenyl)-2-methyl-4-pyrimidinone
OPENEYE Name: 3-(2-fluorophenyl)-2-methyl-pyrimidin-4-one
IUPAC Name: 3-(2-fluorophenyl)-2-methylpyrimidin-4-one
SYSTEMATIC NAME: 3-(2-fluorophenyl)-2-methyl-pyrimidin-4-one
MOLECULAR FORMULA: C11H9FN2O
MOLECULAR WEIGHT: 204.200363
SMILES: CC1=NC=CC(=O)N1C2=CC=CC=C2F
Structure:
CAS RN: 87356-46-5
CAS Name: N'-(2-fluorophenyl)ethanimidamide
OPENEYE Name: N'-(2-fluorophenyl)acetamidine
IUPAC Name: N'-(2-fluorophenyl)ethanimidamide
SYSTEMATIC NAME: N'-(2-fluorophenyl)ethanimidamide
MOLECULAR FORMULA: C8H9FN2
MOLECULAR WEIGHT: 152.168863
SMILES: CC(=NC1=CC=CC=C1F)N
Structure:
CAS RN: 87344-19-2
CAS Name: 2-[1-methyl-5-[(4-methylphenyl)-oxomethyl]-2-pyrrolyl]-1-(4-methyl-1-piperazinyl)ethanone
OPENEYE Name: 2-[1-methyl-5-(4-methylbenzoyl)pyrrol-2-yl]-1-(4-methylpiperazin-1-yl)ethanone
IUPAC Name: 2-[1-methyl-5-(4-methylbenzoyl)pyrrol-2-yl]-1-(4-methylpiperazin-1-yl)ethanone
SYSTEMATIC NAME: 2-[1-methyl-5-(4-methylphenyl)carbonyl-pyrrol-2-yl]-1-(4-methylpiperazin-1-yl)ethanone
MOLECULAR FORMULA: C20H25N3O2
MOLECULAR WEIGHT: 339.4314
SMILES: CC1=CC=C(C=C1)C(=O)C2=CC=C(N2C)CC(=O)N3CCN(CC3)C
Structure:
CAS RN: 87344-16-9
CAS Name: 2-[1-methyl-5-[(4-methylphenyl)-oxomethyl]-2-pyrrolyl]-N'-[2-(4-methyl-1-piperazinyl)-2-oxoethyl]acetohydrazide
OPENEYE Name: 2-[1-methyl-5-(4-methylbenzoyl)pyrrol-2-yl]-N'-[2-(4-methylpiperazin-1-yl)-2-oxo-ethyl]acetohydrazide
IUPAC Name: 2-[1-methyl-5-(4-methylbenzoyl)pyrrol-2-yl]-N'-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]acetohydrazide
SYSTEMATIC NAME: 2-[1-methyl-5-(4-methylphenyl)carbonyl-pyrrol-2-yl]-N'-[2-(4-methylpiperazin-1-yl)-2-oxidanylidene-ethyl]ethanehydrazide
MOLECULAR FORMULA: C22H29N5O3
MOLECULAR WEIGHT: 411.49736
SMILES: CC1=CC=C(C=C1)C(=O)C2=CC=C(N2C)CC(=O)NNCC(=O)N3CCN(CC3)C
Structure:
CAS RN: 87344-11-4
CAS Name: 4-[[2-[1-methyl-5-[(4-methylphenyl)-oxomethyl]-2-pyrrolyl]-1-oxoethyl]amino]benzoic acid ethyl ester
OPENEYE Name: ethyl 4-[[2-[1-methyl-5-(4-methylbenzoyl)pyrrol-2-yl]acetyl]amino]benzoate
IUPAC Name: ethyl 4-[[2-[1-methyl-5-(4-methylbenzoyl)pyrrol-2-yl]acetyl]amino]benzoate
SYSTEMATIC NAME: ethyl 4-[2-[1-methyl-5-(4-methylphenyl)carbonyl-pyrrol-2-yl]ethanoylamino]benzoate
MOLECULAR FORMULA: C24H24N2O4
MOLECULAR WEIGHT: 404.45836
SMILES: CCOC(=O)C1=CC=C(C=C1)NC(=O)CC2=CC=C(N2C)C(=O)C3=CC=C(C=C3)C
Structure:
CAS RN: 87343-65-5
CAS Name: 2,3,4-trimethyl-6-pyrano[2,3-c]pyrazolone
OPENEYE Name: 2,3,4-trimethylpyrano[2,3-c]pyrazol-6-one
IUPAC Name: 2,3,4-trimethylpyrano[2,3-c]pyrazol-6-one
SYSTEMATIC NAME: 2,3,4-trimethylpyrano[2,3-c]pyrazol-6-one
MOLECULAR FORMULA: C9H10N2O2
MOLECULAR WEIGHT: 178.1879
SMILES: CC1=CC(=O)OC2=NN(C(=C12)C)C
Structure:
CAS RN: 87330-70-9
CAS Name: 3-pyridinecarboxylic acid 2-aminoethyl ester dihydrochloride
OPENEYE Name: 2-aminoethyl pyridine-3-carboxylate dihydrochloride
IUPAC Name: 2-aminoethyl pyridine-3-carboxylate dihydrochloride
SYSTEMATIC NAME: 2-azanylethyl pyridine-3-carboxylate dihydrochloride
MOLECULAR FORMULA: C8H12Cl2N2O2
MOLECULAR WEIGHT: 239.09908
SMILES: C1=CC(=CN=C1)C(=O)OCCN.Cl.Cl
Structure:
CAS RN: 87314-99-6
CAS Name: strontium pyridine-2,3-dicarboxylate
OPENEYE Name: strontium pyridine-2,3-dicarboxylate
IUPAC Name: strontium pyridine-2,3-dicarboxylate
SYSTEMATIC NAME: strontium pyridine-2,3-dicarboxylate
MOLECULAR FORMULA: C7H3NO4Sr
MOLECULAR WEIGHT: 252.72302
SMILES: C1=CC(=C(N=C1)C(=O)[O-])C(=O)[O-].[Sr+2]
Structure:
CAS RN: 87309-99-7
CAS Name: 7-chloro-1-methyl-3-(1-pyrrolidinyl)quinazoline-2,4-dione
OPENEYE Name: 7-chloro-1-methyl-3-pyrrolidin-1-yl-quinazoline-2,4-dione
IUPAC Name: 7-chloro-1-methyl-3-pyrrolidin-1-ylquinazoline-2,4-dione
SYSTEMATIC NAME: 7-chloranyl-1-methyl-3-pyrrolidin-1-yl-quinazoline-2,4-dione
MOLECULAR FORMULA: C13H14ClN3O2
MOLECULAR WEIGHT: 279.72216
SMILES: CN1C2=C(C=CC(=C2)Cl)C(=O)N(C1=O)N3CCCC3
Structure:
CAS RN: 87299-55-6
CAS Name: 2,4-dicyclohexyl-7,7-dimethyl-2,3,4,4a,5,6,8,8a-octahydro-1-benzopyran
OPENEYE Name: 2,4-dicyclohexyl-7,7-dimethyl-2,3,4,4a,5,6,8,8a-octahydrochromene
IUPAC Name: 2,4-dicyclohexyl-7,7-dimethyl-2,3,4,4a,5,6,8,8a-octahydrochromene
SYSTEMATIC NAME: 2,4-dicyclohexyl-7,7-dimethyl-2,3,4,4a,5,6,8,8a-octahydrochromene
MOLECULAR FORMULA: C23H40O
MOLECULAR WEIGHT: 332.5631
SMILES: CC1(CCC2C(CC(OC2C1)C3CCCCC3)C4CCCCC4)C
Structure:
CAS RN: 87298-97-3
CAS Name: 2-[bis(2-hydroxyethyl)amino]ethanol; 2-[[4-[4-(carboxymethylthio)phenyl]phenyl]thio]acetic acid
OPENEYE Name: 2-[bis(2-hydroxyethyl)amino]ethanol; 2-[4-[4-(carboxymethylsulfanyl)phenyl]phenyl]sulfanylacetic acid
IUPAC Name: 2-[bis(2-hydroxyethyl)amino]ethanol; 2-[4-[4-(carboxymethylsulfanyl)phenyl]phenyl]sulfanylacetic acid
SYSTEMATIC NAME: 2-[bis(2-hydroxyethyl)amino]ethanol; 2-[4-[4-(2-hydroxy-2-oxoethylsulfanyl)phenyl]phenyl]sulfanylethanoic acid
MOLECULAR FORMULA: C28H44N2O10S2
MOLECULAR WEIGHT: 632.78636
SMILES: C1=CC(=CC=C1C2=CC=C(C=C2)SCC(=O)O)SCC(=O)O.C(CO)N(CCO)CCO.C(CO)N(CCO)CCO
Structure:
CAS RN: 87298-93-9
CAS Name: 2-[(4-chlorophenyl)thio]acetic acid; 2-(4-oxa-1-azaspiro[4.5]decan-1-yl)ethanol
OPENEYE Name: 2-(4-chlorophenyl)sulfanylacetic acid; 2-(4-oxa-1-azaspiro[4.5]decan-1-yl)ethanol
IUPAC Name: 2-(4-chlorophenyl)sulfanylacetic acid; 2-(4-oxa-1-azaspiro[4.5]decan-1-yl)ethanol
SYSTEMATIC NAME: 2-(4-chlorophenyl)sulfanylethanoic acid; 2-(4-oxa-1-azaspiro[4.5]decan-1-yl)ethanol
MOLECULAR FORMULA: C18H26ClNO4S
MOLECULAR WEIGHT: 387.92134
SMILES: C1CCC2(CC1)N(CCO2)CCO.C1=CC(=CC=C1SCC(=O)O)Cl
Structure:
CAS RN: 87296-77-3
CAS Name: 3-amino-2,4-dioxo-1H-quinazoline-6-sulfonamide
OPENEYE Name: 3-amino-2,4-dioxo-1H-quinazoline-6-sulfonamide
IUPAC Name: 3-amino-2,4-dioxo-1H-quinazoline-6-sulfonamide
SYSTEMATIC NAME: 3-azanyl-2,4-bis(oxidanylidene)-1H-quinazoline-6-sulfonamide
MOLECULAR FORMULA: C8H8N4O4S
MOLECULAR WEIGHT: 256.23852
SMILES: C1=CC2=C(C=C1S(=O)(=O)N)C(=O)N(C(=O)N2)N
Structure:
CAS RN: 87296-75-1
CAS Name: 7-chloro-3-(diethylamino)-1-[dimethylamino(hydroxy)methyl]-2,4-dioxo-6-quinazolinesulfonamide
OPENEYE Name: 7-chloro-3-(diethylamino)-1-[dimethylamino(hydroxy)methyl]-2,4-dioxo-quinazoline-6-sulfonamide
IUPAC Name: 7-chloro-3-(diethylamino)-1-[dimethylamino(hydroxy)methyl]-2,4-dioxoquinazoline-6-sulfonamide
SYSTEMATIC NAME: 7-chloranyl-3-(diethylamino)-1-[dimethylamino(oxidanyl)methyl]-2,4-bis(oxidanylidene)quinazoline-6-sulfonamide
MOLECULAR FORMULA: C15H22ClN5O5S
MOLECULAR WEIGHT: 419.88368
SMILES: CCN(CC)N1C(=O)C2=CC(=C(C=C2N(C1=O)C(N(C)C)O)Cl)S(=O)(=O)N
Structure:
CAS RN: 87296-69-3
CAS Name: 7-chloro-1-methyl-3-(1-piperidinyl)quinazoline-2,4-dione
OPENEYE Name: 7-chloro-1-methyl-3-(1-piperidyl)quinazoline-2,4-dione
IUPAC Name: 7-chloro-1-methyl-3-piperidin-1-ylquinazoline-2,4-dione
SYSTEMATIC NAME: 7-chloranyl-1-methyl-3-piperidin-1-yl-quinazoline-2,4-dione
MOLECULAR FORMULA: C14H16ClN3O2
MOLECULAR WEIGHT: 293.74874
SMILES: CN1C2=C(C=CC(=C2)Cl)C(=O)N(C1=O)N3CCCCC3
Structure:
CAS RN: 87296-68-2
CAS Name: 7-chloro-1-methyl-3-(4-morpholinyl)quinazoline-2,4-dione
OPENEYE Name: 7-chloro-1-methyl-3-morpholino-quinazoline-2,4-dione
IUPAC Name: 7-chloro-1-methyl-3-morpholin-4-ylquinazoline-2,4-dione
SYSTEMATIC NAME: 7-chloranyl-1-methyl-3-morpholin-4-yl-quinazoline-2,4-dione
MOLECULAR FORMULA: C13H14ClN3O3
MOLECULAR WEIGHT: 295.72156
SMILES: CN1C2=C(C=CC(=C2)Cl)C(=O)N(C1=O)N3CCOCC3
Structure:
CAS RN: 87296-66-0
CAS Name: 7-chloro-3-(diethylamino)-1-prop-2-enylquinazoline-2,4-dione
OPENEYE Name: 1-allyl-7-chloro-3-(diethylamino)quinazoline-2,4-dione
IUPAC Name: 7-chloro-3-(diethylamino)-1-prop-2-enylquinazoline-2,4-dione
SYSTEMATIC NAME: 7-chloranyl-3-(diethylamino)-1-prop-2-enyl-quinazoline-2,4-dione
MOLECULAR FORMULA: C15H18ClN3O2
MOLECULAR WEIGHT: 307.77532
SMILES: CCN(CC)N1C(=O)C2=C(C=C(C=C2)Cl)N(C1=O)CC=C
Structure:
CAS RN: 87296-65-9
CAS Name: 7-chloro-3-(diethylamino)-1-ethylquinazoline-2,4-dione
OPENEYE Name: 7-chloro-3-(diethylamino)-1-ethyl-quinazoline-2,4-dione
IUPAC Name: 7-chloro-3-(diethylamino)-1-ethylquinazoline-2,4-dione
SYSTEMATIC NAME: 7-chloranyl-3-(diethylamino)-1-ethyl-quinazoline-2,4-dione
MOLECULAR FORMULA: C14H18ClN3O2
MOLECULAR WEIGHT: 295.76462
SMILES: CCN1C2=C(C=CC(=C2)Cl)C(=O)N(C1=O)N(CC)CC
Structure:
CAS RN: 87296-64-8
CAS Name: 7-chloro-3-(diethylamino)-1-methylquinazoline-2,4-dione
OPENEYE Name: 7-chloro-3-(diethylamino)-1-methyl-quinazoline-2,4-dione
IUPAC Name: 7-chloro-3-(diethylamino)-1-methylquinazoline-2,4-dione
SYSTEMATIC NAME: 7-chloranyl-3-(diethylamino)-1-methyl-quinazoline-2,4-dione
MOLECULAR FORMULA: C13H16ClN3O2
MOLECULAR WEIGHT: 281.73804
SMILES: CCN(CC)N1C(=O)C2=C(C=C(C=C2)Cl)N(C1=O)C
Structure:
CAS RN: 87296-61-5
CAS Name: 3-(dimethylamino)-1-(phenylmethyl)quinazoline-2,4-dione
OPENEYE Name: 1-benzyl-3-(dimethylamino)quinazoline-2,4-dione
IUPAC Name: 1-benzyl-3-(dimethylamino)quinazoline-2,4-dione
SYSTEMATIC NAME: 3-(dimethylamino)-1-(phenylmethyl)quinazoline-2,4-dione
MOLECULAR FORMULA: C17H17N3O2
MOLECULAR WEIGHT: 295.33578
SMILES: CN(C)N1C(=O)C2=CC=CC=C2N(C1=O)CC3=CC=CC=C3
Structure:
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