CAS RN: 5861-11-0
CAS Name: 2-methyl-4-(6-methyl-4-oxo-1-benzopyran-3-yl)-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylic acid (4-methoxyphenyl)methyl ester
OPENEYE Name: (4-methoxyphenyl)methyl 2-methyl-4-(6-methyl-4-oxo-chromen-3-yl)-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
IUPAC Name: (4-methoxyphenyl)methyl 2-methyl-4-(6-methyl-4-oxochromen-3-yl)-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
SYSTEMATIC NAME: (4-methoxyphenyl)methyl 2-methyl-4-(6-methyl-4-oxidanylidene-chromen-3-yl)-5-oxidanylidene-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
MOLECULAR FORMULA: C29H27NO6
MOLECULAR WEIGHT: 485.52778
SMILES: CC1=CC2=C(C=C1)OC=C(C2=O)C3C4=C(CCCC4=O)NC(=C3C(=O)OCC5=CC=C(C=C5)OC)C
Structure:
CAS RN: 5860-95-7
CAS Name: N-(2-chlorophenyl)-4-(2,5-dimethoxyphenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxamide
OPENEYE Name: N-(2-chlorophenyl)-4-(2,5-dimethoxyphenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxamide
IUPAC Name: N-(2-chlorophenyl)-4-(2,5-dimethoxyphenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxamide
SYSTEMATIC NAME: N-(2-chlorophenyl)-4-(2,5-dimethoxyphenyl)-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide
MOLECULAR FORMULA: C20H20ClN3O4
MOLECULAR WEIGHT: 401.8435
SMILES: CC1=C(C(NC(=O)N1)C2=C(C=CC(=C2)OC)OC)C(=O)NC3=CC=CC=C3Cl
Structure:
CAS RN: 5860-68-4
CAS Name: 4-[oxo-[4-(2-phenylethynyl)phenyl]methyl]-1-piperazinecarboxylic acid ethyl ester
OPENEYE Name: ethyl 4-[4-(2-phenylethynyl)benzoyl]piperazine-1-carboxylate
IUPAC Name: ethyl 4-[4-(2-phenylethynyl)benzoyl]piperazine-1-carboxylate
SYSTEMATIC NAME: ethyl 4-[4-(2-phenylethynyl)phenyl]carbonylpiperazine-1-carboxylate
MOLECULAR FORMULA: C22H22N2O3
MOLECULAR WEIGHT: 362.42168
SMILES: CCOC(=O)N1CCN(CC1)C(=O)C2=CC=C(C=C2)C#CC3=CC=CC=C3
Structure:
CAS RN: 5859-90-5
CAS Name: 4-(4-hydroxy-3,5-dimethoxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylic acid 2-phenoxyethyl ester
OPENEYE Name: 2-phenoxyethyl 4-(4-hydroxy-3,5-dimethoxy-phenyl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate
IUPAC Name: 2-phenoxyethyl 4-(4-hydroxy-3,5-dimethoxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate
SYSTEMATIC NAME: 2-phenoxyethyl 4-(3,5-dimethoxy-4-oxidanyl-phenyl)-2,7,7-trimethyl-5-oxidanylidene-1,4,6,8-tetrahydroquinoline-3-carboxylate
MOLECULAR FORMULA: C29H33NO7
MOLECULAR WEIGHT: 507.57482
SMILES: CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=CC(=C(C(=C3)OC)O)OC)C(=O)OCCOC4=CC=CC=C4
Structure:
CAS RN: 126484-23-9
CAS Name: 1-ethyl-5-(ethylthio)-2-phenylimidazole hydrochloride
OPENEYE Name: 1-ethyl-5-ethylsulfanyl-2-phenyl-imidazole hydrochloride
IUPAC Name: 1-ethyl-5-ethylsulfanyl-2-phenylimidazole hydrochloride
SYSTEMATIC NAME: 1-ethyl-5-ethylsulfanyl-2-phenyl-imidazole hydrochloride
MOLECULAR FORMULA: C13H17ClN2S
MOLECULAR WEIGHT: 268.80548
SMILES: CCN1C(=CN=C1C2=CC=CC=C2)SCC.Cl
Structure:
CAS RN: 5858-94-6
CAS Name: 2-[[2,5-dioxo-1-(4-propoxyphenyl)-3-pyrrolidinyl]amino]acetic acid methyl ester
OPENEYE Name: methyl 2-[[2,5-dioxo-1-(4-propoxyphenyl)pyrrolidin-3-yl]amino]acetate
IUPAC Name: methyl 2-[[2,5-dioxo-1-(4-propoxyphenyl)pyrrolidin-3-yl]amino]acetate
SYSTEMATIC NAME: methyl 2-[[2,5-bis(oxidanylidene)-1-(4-propoxyphenyl)pyrrolidin-3-yl]amino]ethanoate
MOLECULAR FORMULA: C16H20N2O5
MOLECULAR WEIGHT: 320.3404
SMILES: CCCOC1=CC=C(C=C1)N2C(=O)CC(C2=O)NCC(=O)OC
Structure:
CAS RN: 5858-77-5
CAS Name: 2-[2-[4-[[4-(4-morpholinylsulfonyl)phenyl]-oxomethyl]-1-piperazinyl]ethyl]benzo[de]isoquinoline-1,3-dione
OPENEYE Name: 2-[2-[4-(4-morpholinosulfonylbenzoyl)piperazin-1-yl]ethyl]benzo[de]isoquinoline-1,3-dione
IUPAC Name: 2-[2-[4-(4-morpholin-4-ylsulfonylbenzoyl)piperazin-1-yl]ethyl]benzo[de]isoquinoline-1,3-dione
SYSTEMATIC NAME: 2-[2-[4-(4-morpholin-4-ylsulfonylphenyl)carbonylpiperazin-1-yl]ethyl]benzo[de]isoquinoline-1,3-dione
MOLECULAR FORMULA: C29H30N4O6S
MOLECULAR WEIGHT: 562.6367
SMILES: C1CN(CCN1CCN2C(=O)C3=CC=CC4=C3C(=CC=C4)C2=O)C(=O)C5=CC=C(C=C5)S(=O)(=O)N6CCOCC6
Structure:
CAS RN: 5857-46-5
CAS Name: N-methyl-N'-[2-[4-[(3-nitrophenyl)-oxomethyl]-1-piperazinyl]ethyl]oxamide
OPENEYE Name: N-methyl-N'-[2-[4-(3-nitrobenzoyl)piperazin-1-yl]ethyl]oxamide
IUPAC Name: N-methyl-N'-[2-[4-(3-nitrobenzoyl)piperazin-1-yl]ethyl]oxamide
SYSTEMATIC NAME: N-methyl-N'-[2-[4-(3-nitrophenyl)carbonylpiperazin-1-yl]ethyl]ethanediamide
MOLECULAR FORMULA: C16H21N5O5
MOLECULAR WEIGHT: 363.36844
SMILES: CNC(=O)C(=O)NCCN1CCN(CC1)C(=O)C2=CC(=CC=C2)[N+](=O)[O-]
Structure:
CAS RN: 5857-08-9
CAS Name: 2,7,7-trimethyl-4-(4-nitrophenyl)-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylic acid 2-propoxyethyl ester
OPENEYE Name: 2-propoxyethyl 2,7,7-trimethyl-4-(4-nitrophenyl)-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate
IUPAC Name: 2-propoxyethyl 2,7,7-trimethyl-4-(4-nitrophenyl)-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate
SYSTEMATIC NAME: 2-propoxyethyl 2,7,7-trimethyl-4-(4-nitrophenyl)-5-oxidanylidene-1,4,6,8-tetrahydroquinoline-3-carboxylate
MOLECULAR FORMULA: C24H30N2O6
MOLECULAR WEIGHT: 442.5048
SMILES: CCCOCCOC(=O)C1=C(NC2=C(C1C3=CC=C(C=C3)[N+](=O)[O-])C(=O)CC(C2)(C)C)C
Structure:
CAS RN: 94160-04-0
CAS Name: 3-amino-4-chloro-N-phenylbenzenesulfonamide
OPENEYE Name: 3-amino-4-chloro-N-phenyl-benzenesulfonamide
IUPAC Name: 3-amino-4-chloro-N-phenylbenzenesulfonamide
SYSTEMATIC NAME: 3-azanyl-4-chloranyl-N-phenyl-benzenesulfonamide
MOLECULAR FORMULA: C12H11ClN2O2S
MOLECULAR WEIGHT: 282.74594
SMILES: C1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)Cl)N
Structure:
CAS RN: 5856-25-7
CAS Name: 4-(4-methoxycarbonylphenyl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylic acid 2-propan-2-yloxyethyl ester
OPENEYE Name: 2-isopropoxyethyl 4-(4-methoxycarbonylphenyl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate
IUPAC Name: 2-propan-2-yloxyethyl 4-(4-methoxycarbonylphenyl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate
SYSTEMATIC NAME: 2-propan-2-yloxyethyl 4-(4-methoxycarbonylphenyl)-2,7,7-trimethyl-5-oxidanylidene-1,4,6,8-tetrahydroquinoline-3-carboxylate
MOLECULAR FORMULA: C26H33NO6
MOLECULAR WEIGHT: 455.54332
SMILES: CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=CC=C(C=C3)C(=O)OC)C(=O)OCCOC(C)C
Structure:
CAS RN: 5855-67-4
CAS Name: 2-[4-(4-methoxyphenyl)-1-imidazolyl]-N-methyl-4-nitroaniline
OPENEYE Name: 2-[4-(4-methoxyphenyl)imidazol-1-yl]-N-methyl-4-nitro-aniline
IUPAC Name: 2-[4-(4-methoxyphenyl)imidazol-1-yl]-N-methyl-4-nitroaniline
SYSTEMATIC NAME: 2-[4-(4-methoxyphenyl)imidazol-1-yl]-N-methyl-4-nitro-aniline
MOLECULAR FORMULA: C17H16N4O3
MOLECULAR WEIGHT: 324.33394
SMILES: CNC1=C(C=C(C=C1)[N+](=O)[O-])N2C=C(N=C2)C3=CC=C(C=C3)OC
Structure:
CAS RN: 5853-09-8
CAS Name: 7-iodo-N',N'-dimethyl-9H-fluorene-4-carbohydrazide
OPENEYE Name: 7-iodo-N',N'-dimethyl-9H-fluorene-4-carbohydrazide
IUPAC Name: 7-iodo-N',N'-dimethyl-9H-fluorene-4-carbohydrazide
SYSTEMATIC NAME: 7-iodanyl-N',N'-dimethyl-9H-fluorene-4-carbohydrazide
MOLECULAR FORMULA: C16H15IN2O
MOLECULAR WEIGHT: 378.20757
SMILES: CN(C)NC(=O)C1=C2C(=CC=C1)CC3=C2C=CC(=C3)I
Structure:
CAS RN: 15407-92-8
CAS Name: 2-[2-(1-methyl-2-pyridin-1-iumyl)ethenyl]phenol iodide
OPENEYE Name: 2-[2-(1-methylpyridin-1-ium-2-yl)vinyl]phenol iodide
IUPAC Name: 2-[2-(1-methylpyridin-1-ium-2-yl)ethenyl]phenol iodide
SYSTEMATIC NAME: 2-[2-(1-methylpyridin-1-ium-2-yl)ethenyl]phenol iodide
MOLECULAR FORMULA: C14H14INO
MOLECULAR WEIGHT: 339.17153
SMILES: C[N+]1=CC=CC=C1C=CC2=CC=CC=C2O.[I-]
Structure:
CAS RN: 5852-40-4
CAS Name: (5Z)-3-(1,1-dioxo-3-thiolanyl)-5-(1-ethyl-2-oxo-3-indolylidene)-2-sulfanylidene-4-thiazolidinone
OPENEYE Name: (5Z)-3-(1,1-dioxothiolan-3-yl)-5-(1-ethyl-2-oxo-indolin-3-ylidene)-2-thioxo-thiazolidin-4-one
IUPAC Name: (5Z)-3-(1,1-dioxothiolan-3-yl)-5-(1-ethyl-2-oxoindol-3-ylidene)-2-sulfanylidene-1,3-thiazolidin-4-one
SYSTEMATIC NAME: (5Z)-3-[1,1-bis(oxidanylidene)thiolan-3-yl]-5-(1-ethyl-2-oxidanylidene-indol-3-ylidene)-2-sulfanylidene-1,3-thiazolidin-4-one
MOLECULAR FORMULA: C17H16N2O4S3
MOLECULAR WEIGHT: 408.51494
SMILES: CCN1C2=CC=CC=C2/C(=C/3\C(=O)N(C(=S)S3)C4CCS(=O)(=O)C4)/C1=O
Structure:
CAS RN: 5851-77-4
CAS Name: acetic acid [4-[[2-(6,7-dimethyl-3-oxo-2,4-dihydro-1H-quinoxalin-2-yl)-1-oxoethyl]amino]phenyl] ester
OPENEYE Name: [4-[[2-(6,7-dimethyl-3-oxo-2,4-dihydro-1H-quinoxalin-2-yl)acetyl]amino]phenyl] acetate
IUPAC Name: [4-[[2-(6,7-dimethyl-3-oxo-2,4-dihydro-1H-quinoxalin-2-yl)acetyl]amino]phenyl] acetate
SYSTEMATIC NAME: [4-[2-(6,7-dimethyl-3-oxidanylidene-2,4-dihydro-1H-quinoxalin-2-yl)ethanoylamino]phenyl] ethanoate
MOLECULAR FORMULA: C20H21N3O4
MOLECULAR WEIGHT: 367.39844
SMILES: CC1=CC2=C(C=C1C)NC(=O)C(N2)CC(=O)NC3=CC=C(C=C3)OC(=O)C
Structure:
CAS RN: 5851-71-8
CAS Name: 3-(2-furanyl)-2-(2-methylphenyl)-5-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d]isoxazole-4,6-dione
OPENEYE Name: 3-(2-furyl)-2-(o-tolyl)-5-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d]isoxazole-4,6-dione
IUPAC Name: 3-(furan-2-yl)-2-(2-methylphenyl)-5-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione
SYSTEMATIC NAME: 3-(furan-2-yl)-2-(2-methylphenyl)-5-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione
MOLECULAR FORMULA: C22H18N2O4
MOLECULAR WEIGHT: 374.38932
SMILES: CC1=CC=CC=C1N2C(C3C(O2)C(=O)N(C3=O)C4=CC=CC=C4)C5=CC=CO5
Structure:
CAS RN: 5850-97-5
CAS Name: 2-[(4-bromophenyl)methyl]-5-(4-methoxyphenyl)-7-methyl-3-oxo-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid ethyl ester
OPENEYE Name: ethyl 2-[(4-bromophenyl)methyl]-5-(4-methoxyphenyl)-7-methyl-3-oxo-5H-thiazolo[3,2-a]pyrimidine-6-carboxylate
IUPAC Name: ethyl 2-[(4-bromophenyl)methyl]-5-(4-methoxyphenyl)-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
SYSTEMATIC NAME: ethyl 2-[(4-bromophenyl)methyl]-5-(4-methoxyphenyl)-7-methyl-3-oxidanylidene-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
MOLECULAR FORMULA: C24H23BrN2O4S
MOLECULAR WEIGHT: 515.41942
SMILES: CCOC(=O)C1=C(N=C2N(C1C3=CC=C(C=C3)OC)C(=O)C(S2)CC4=CC=C(C=C4)Br)C
Structure:
CAS RN: 5850-42-0
CAS Name: N-[5-[2-[2-[2-(5-benzamido-1,3,4-thiadiazol-2-yl)ethoxy]propoxy]ethyl]-1,3,4-thiadiazol-2-yl]benzamide
OPENEYE Name: N-[5-[2-[2-[2-(5-benzamido-1,3,4-thiadiazol-2-yl)ethoxy]propoxy]ethyl]-1,3,4-thiadiazol-2-yl]benzamide
IUPAC Name: N-[5-[2-[2-[2-(5-benzamido-1,3,4-thiadiazol-2-yl)ethoxy]propoxy]ethyl]-1,3,4-thiadiazol-2-yl]benzamide
SYSTEMATIC NAME: N-[5-[2-[2-[2-(5-benzamido-1,3,4-thiadiazol-2-yl)ethoxy]propoxy]ethyl]-1,3,4-thiadiazol-2-yl]benzamide
MOLECULAR FORMULA: C25H26N6O4S2
MOLECULAR WEIGHT: 538.64174
SMILES: CC(COCCC1=NN=C(S1)NC(=O)C2=CC=CC=C2)OCCC3=NN=C(S3)NC(=O)C4=CC=CC=C4
Structure:
CAS RN: 4323-98-2
CAS Name: N-(8-tert-butyl-6,7,8,9-tetrahydrodibenzofuran-2-yl)-4-ethoxybenzenesulfonamide
OPENEYE Name: N-(8-tert-butyl-6,7,8,9-tetrahydrodibenzofuran-2-yl)-4-ethoxy-benzenesulfonamide
IUPAC Name: N-(8-tert-butyl-6,7,8,9-tetrahydrodibenzofuran-2-yl)-4-ethoxybenzenesulfonamide
SYSTEMATIC NAME: N-(8-tert-butyl-6,7,8,9-tetrahydrodibenzofuran-2-yl)-4-ethoxy-benzenesulfonamide
MOLECULAR FORMULA: C24H29NO4S
MOLECULAR WEIGHT: 427.55636
SMILES: CCOC1=CC=C(C=C1)S(=O)(=O)NC2=CC3=C(C=C2)OC4=C3CC(CC4)C(C)(C)C
Structure:
CAS RN: 5850-28-2
CAS Name: 4-(5-bromo-2-methoxyphenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylic acid propyl ester
OPENEYE Name: propyl 4-(5-bromo-2-methoxy-phenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
IUPAC Name: propyl 4-(5-bromo-2-methoxyphenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
SYSTEMATIC NAME: propyl 4-(5-bromanyl-2-methoxy-phenyl)-2-methyl-5-oxidanylidene-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
MOLECULAR FORMULA: C21H24BrNO4
MOLECULAR WEIGHT: 434.32356
SMILES: CCCOC(=O)C1=C(NC2=C(C1C3=C(C=CC(=C3)Br)OC)C(=O)CCC2)C
Structure:
CAS RN: 5850-24-8
CAS Name: 1-(3,4-dimethylphenyl)sulfonyl-5-nitrobenzimidazole
OPENEYE Name: 1-(3,4-dimethylphenyl)sulfonyl-5-nitro-benzimidazole
IUPAC Name: 1-(3,4-dimethylphenyl)sulfonyl-5-nitrobenzimidazole
SYSTEMATIC NAME: 1-(3,4-dimethylphenyl)sulfonyl-5-nitro-benzimidazole
MOLECULAR FORMULA: C15H13N3O4S
MOLECULAR WEIGHT: 331.34642
SMILES: CC1=C(C=C(C=C1)S(=O)(=O)N2C=NC3=C2C=CC(=C3)[N+](=O)[O-])C
Structure:
CAS RN: 5849-70-7
CAS Name: 5-[(3-chlorophenyl)methyl]-2-(4-fluoroanilino)-4-thiazolone
OPENEYE Name: 5-[(3-chlorophenyl)methyl]-2-(4-fluoroanilino)thiazol-4-one
IUPAC Name: 5-[(3-chlorophenyl)methyl]-2-(4-fluoroanilino)-1,3-thiazol-4-one
SYSTEMATIC NAME: 5-[(3-chlorophenyl)methyl]-2-[(4-fluorophenyl)amino]-1,3-thiazol-4-one
MOLECULAR FORMULA: C16H12ClFN2OS
MOLECULAR WEIGHT: 334.795683
SMILES: C1=CC(=CC(=C1)Cl)CC2C(=O)N=C(S2)NC3=CC=C(C=C3)F
Structure:
CAS RN: 5849-02-5
CAS Name: 2-hydroxy-7-(3-methylbutoxy)-9-fluorenone
OPENEYE Name: 2-hydroxy-7-isopentyloxy-fluoren-9-one
IUPAC Name: 2-hydroxy-7-(3-methylbutoxy)fluoren-9-one
SYSTEMATIC NAME: 2-(3-methylbutoxy)-7-oxidanyl-fluoren-9-one
MOLECULAR FORMULA: C18H18O3
MOLECULAR WEIGHT: 282.33372
SMILES: CC(C)CCOC1=CC2=C(C=C1)C3=C(C2=O)C=C(C=C3)O
Structure:
CAS RN: 4332-95-0
CAS Name: 5-[(4-hydroxyphenyl)methyl]-3-phenyl-2-sulfanylidene-4-imidazolidinone
OPENEYE Name: 5-[(4-hydroxyphenyl)methyl]-3-phenyl-2-thioxo-imidazolidin-4-one
IUPAC Name: 5-[(4-hydroxyphenyl)methyl]-3-phenyl-2-sulfanylideneimidazolidin-4-one
SYSTEMATIC NAME: 5-[(4-hydroxyphenyl)methyl]-3-phenyl-2-sulfanylidene-imidazolidin-4-one
MOLECULAR FORMULA: C16H14N2O2S
MOLECULAR WEIGHT: 298.35956
SMILES: C1=CC=C(C=C1)N2C(=O)C(NC2=S)CC3=CC=C(C=C3)O
Structure:
CAS RN: 29588-08-7
CAS Name: 5-[(4-hydroxyphenyl)methyl]-3-phenyl-2-sulfanylidene-4-imidazolidinone
OPENEYE Name: 5-[(4-hydroxyphenyl)methyl]-3-phenyl-2-thioxo-imidazolidin-4-one
IUPAC Name: 5-[(4-hydroxyphenyl)methyl]-3-phenyl-2-sulfanylideneimidazolidin-4-one
SYSTEMATIC NAME: 5-[(4-hydroxyphenyl)methyl]-3-phenyl-2-sulfanylidene-imidazolidin-4-one
MOLECULAR FORMULA: C16H14N2O2S
MOLECULAR WEIGHT: 298.35956
SMILES: C1=CC=C(C=C1)N2C(=O)C(NC2=S)CC3=CC=C(C=C3)O
Structure:
CAS RN: 5847-07-4
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C22H31NO4
MOLECULAR WEIGHT: 373.48584
SMILES: CCCNC(=O)OCC12COC3C(C1C)C(CC2C)(OC4=CC=CC=C34)C
Structure:
CAS RN: 5846-35-5
CAS Name: 6-amino-4-(3-chlorophenyl)-3-methyl-1-(phenylmethyl)-4H-pyrano[2,3-c]pyrazole-5-carbonitrile
OPENEYE Name: 6-amino-1-benzyl-4-(3-chlorophenyl)-3-methyl-4H-pyrano[2,3-c]pyrazole-5-carbonitrile
IUPAC Name: 6-amino-1-benzyl-4-(3-chlorophenyl)-3-methyl-4H-pyrano[2,3-c]pyrazole-5-carbonitrile
SYSTEMATIC NAME: 6-azanyl-4-(3-chlorophenyl)-3-methyl-1-(phenylmethyl)-4H-pyrano[2,3-c]pyrazole-5-carbonitrile
MOLECULAR FORMULA: C21H17ClN4O
MOLECULAR WEIGHT: 376.83888
SMILES: CC1=NN(C2=C1C(C(=C(O2)N)C#N)C3=CC(=CC=C3)Cl)CC4=CC=CC=C4
Structure:
CAS RN: 4333-19-1
CAS Name: 5-methyl-3-phenyl-2-sulfanylidene-4-imidazolidinone
OPENEYE Name: 5-methyl-3-phenyl-2-thioxo-imidazolidin-4-one
IUPAC Name: 5-methyl-3-phenyl-2-sulfanylideneimidazolidin-4-one
SYSTEMATIC NAME: 5-methyl-3-phenyl-2-sulfanylidene-imidazolidin-4-one
MOLECULAR FORMULA: C10H10N2OS
MOLECULAR WEIGHT: 206.2642
SMILES: CC1C(=O)N(C(=S)N1)C2=CC=CC=C2
Structure:
CAS RN: 5845-98-7
CAS Name: 2-[[3-methyl-1-oxo-2-(phenylmethoxycarbonylamino)butyl]amino]propanoic acid (4-nitrophenyl)methyl ester
OPENEYE Name: (4-nitrophenyl)methyl 2-[[2-(benzyloxycarbonylamino)-3-methyl-butanoyl]amino]propanoate
IUPAC Name: (4-nitrophenyl)methyl 2-[[3-methyl-2-(phenylmethoxycarbonylamino)butanoyl]amino]propanoate
SYSTEMATIC NAME: (4-nitrophenyl)methyl 2-[[3-methyl-2-(phenylmethoxycarbonylamino)butanoyl]amino]propanoate
MOLECULAR FORMULA: C23H27N3O7
MOLECULAR WEIGHT: 457.47638
SMILES: CC(C)C(C(=O)NC(C)C(=O)OCC1=CC=C(C=C1)[N+](=O)[O-])NC(=O)OCC2=CC=CC=C2
Structure:
CAS RN: 5845-36-3
CAS Name: 4-[2-fluoro-4-nitro-5-(1-pyrrolidinyl)phenyl]morpholine
OPENEYE Name: 4-(2-fluoro-4-nitro-5-pyrrolidin-1-yl-phenyl)morpholine
IUPAC Name: 4-(2-fluoro-4-nitro-5-pyrrolidin-1-ylphenyl)morpholine
SYSTEMATIC NAME: 4-(2-fluoranyl-4-nitro-5-pyrrolidin-1-yl-phenyl)morpholine
MOLECULAR FORMULA: C14H18FN3O3
MOLECULAR WEIGHT: 295.309423
SMILES: C1CCN(C1)C2=CC(=C(C=C2[N+](=O)[O-])F)N3CCOCC3
Structure:
CAS RN: 5844-88-2
CAS Name: 1-methyl-3-(2,4,9-trimethyl-7-oxabicyclo[3.3.1]non-3-en-6-yl)pyridin-1-ium iodide
OPENEYE Name: 1-methyl-3-(2,4,9-trimethyl-7-oxabicyclo[3.3.1]non-3-en-6-yl)pyridin-1-ium iodide
IUPAC Name: 1-methyl-3-(2,4,9-trimethyl-7-oxabicyclo[3.3.1]non-3-en-6-yl)pyridin-1-ium iodide
SYSTEMATIC NAME: 1-methyl-3-(2,4,9-trimethyl-7-oxabicyclo[3.3.1]non-3-en-6-yl)pyridin-1-ium iodide
MOLECULAR FORMULA: C17H24INO
MOLECULAR WEIGHT: 385.28303
SMILES: CC1C=C(C2C(C1COC2C3=C[N+](=CC=C3)C)C)C.[I-]
Structure:
CAS RN: 5844-25-7
CAS Name: 2-(4-bromophenoxy)-N-(3-dibenzofuranyl)acetamide
OPENEYE Name: 2-(4-bromophenoxy)-N-dibenzofuran-3-yl-acetamide
IUPAC Name: 2-(4-bromophenoxy)-N-dibenzofuran-3-ylacetamide
SYSTEMATIC NAME: 2-(4-bromanylphenoxy)-N-dibenzofuran-3-yl-ethanamide
MOLECULAR FORMULA: C20H14BrNO3
MOLECULAR WEIGHT: 396.23406
SMILES: C1=CC=C2C(=C1)C3=C(O2)C=C(C=C3)NC(=O)COC4=CC=C(C=C4)Br
Structure:
CAS RN: 5844-18-8
CAS Name: 2-[4-(4-fluorophenyl)-2-thiazolyl]-4,5-dimethyl-4H-pyrazol-3-one
OPENEYE Name: 2-[4-(4-fluorophenyl)thiazol-2-yl]-4,5-dimethyl-4H-pyrazol-3-one
IUPAC Name: 2-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-4,5-dimethyl-4H-pyrazol-3-one
SYSTEMATIC NAME: 2-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-4,5-dimethyl-4H-pyrazol-3-one
MOLECULAR FORMULA: C14H12FN3OS
MOLECULAR WEIGHT: 289.327983
SMILES: CC1C(=NN(C1=O)C2=NC(=CS2)C3=CC=C(C=C3)F)C
Structure:
CAS RN: 5844-06-4
CAS Name: 2-[2-[(2,6-dichlorophenyl)thio]ethyl]pyridine; oxalic acid
OPENEYE Name: 2-[2-(2,6-dichlorophenyl)sulfanylethyl]pyridine; oxalic acid
IUPAC Name: 2-[2-(2,6-dichlorophenyl)sulfanylethyl]pyridine; oxalic acid
SYSTEMATIC NAME: 2-[2-[2,6-bis(chloranyl)phenyl]sulfanylethyl]pyridine; ethanedioic acid
MOLECULAR FORMULA: C15H13Cl2NO4S
MOLECULAR WEIGHT: 374.23902
SMILES: C1=CC=NC(=C1)CCSC2=C(C=CC=C2Cl)Cl.C(=O)(C(=O)O)O
Structure:
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