CAS RN: 5687-16-1
CAS Name: 2-(4-methoxyphenoxy)-N-(4-methoxyphenyl)acetamide
OPENEYE Name: 2-(4-methoxyphenoxy)-N-(4-methoxyphenyl)acetamide
IUPAC Name: 2-(4-methoxyphenoxy)-N-(4-methoxyphenyl)acetamide
SYSTEMATIC NAME: 2-(4-methoxyphenoxy)-N-(4-methoxyphenyl)ethanamide
MOLECULAR FORMULA: C16H17NO4
MOLECULAR WEIGHT: 287.31048
SMILES: COC1=CC=C(C=C1)NC(=O)COC2=CC=C(C=C2)OC
Structure:
CAS RN: 5686-39-5
CAS Name: 3-(2-chlorophenyl)-5-[(4-methoxyphenoxy)methyl]-1,2,4-oxadiazole
OPENEYE Name: 3-(2-chlorophenyl)-5-[(4-methoxyphenoxy)methyl]-1,2,4-oxadiazole
IUPAC Name: 3-(2-chlorophenyl)-5-[(4-methoxyphenoxy)methyl]-1,2,4-oxadiazole
SYSTEMATIC NAME: 3-(2-chlorophenyl)-5-[(4-methoxyphenoxy)methyl]-1,2,4-oxadiazole
MOLECULAR FORMULA: C16H13ClN2O3
MOLECULAR WEIGHT: 316.73902
SMILES: COC1=CC=C(C=C1)OCC2=NC(=NO2)C3=CC=CC=C3Cl
Structure:
CAS RN: 5684-99-1
CAS Name: 5-(3-methoxyphenyl)-3-(3-nitrophenyl)-1,2,4-oxadiazole
OPENEYE Name: 5-(3-methoxyphenyl)-3-(3-nitrophenyl)-1,2,4-oxadiazole
IUPAC Name: 5-(3-methoxyphenyl)-3-(3-nitrophenyl)-1,2,4-oxadiazole
SYSTEMATIC NAME: 5-(3-methoxyphenyl)-3-(3-nitrophenyl)-1,2,4-oxadiazole
MOLECULAR FORMULA: C15H11N3O4
MOLECULAR WEIGHT: 297.26554
SMILES: COC1=CC=CC(=C1)C2=NC(=NO2)C3=CC(=CC=C3)[N+](=O)[O-]
Structure:
CAS RN: 5684-95-7
CAS Name: 3-hydroxy-N'-[(4-methoxyphenyl)-oxomethyl]benzohydrazide
OPENEYE Name: 3-hydroxy-N'-(4-methoxybenzoyl)benzohydrazide
IUPAC Name: 3-hydroxy-N'-(4-methoxybenzoyl)benzohydrazide
SYSTEMATIC NAME: N'-(4-methoxyphenyl)carbonyl-3-oxidanyl-benzohydrazide
MOLECULAR FORMULA: C15H14N2O4
MOLECULAR WEIGHT: 286.28266
SMILES: COC1=CC=C(C=C1)C(=O)NNC(=O)C2=CC(=CC=C2)O
Structure:
CAS RN: 340213-60-7
CAS Name: (5E)-1-(4-chlorophenyl)-5-(2-furanylmethylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione
OPENEYE Name: (5E)-1-(4-chlorophenyl)-5-(2-furylmethylene)-2-thioxo-hexahydropyrimidine-4,6-dione
IUPAC Name: (5E)-1-(4-chlorophenyl)-5-(furan-2-ylmethylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione
SYSTEMATIC NAME: (5E)-1-(4-chlorophenyl)-5-(furan-2-ylmethylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione
MOLECULAR FORMULA: C15H9ClN2O3S
MOLECULAR WEIGHT: 332.76156
SMILES: C1=COC(=C1)/C=C/2\C(=O)NC(=S)N(C2=O)C3=CC=C(C=C3)Cl
Structure:
CAS RN: 5670-75-7
CAS Name: 1-(2-anilino-5-benzoyl-3-thiophenyl)ethanone
OPENEYE Name: 1-(2-anilino-5-benzoyl-3-thienyl)ethanone
IUPAC Name: 1-(2-anilino-5-benzoylthiophen-3-yl)ethanone
SYSTEMATIC NAME: 1-[2-phenylazanyl-5-(phenylcarbonyl)thiophen-3-yl]ethanone
MOLECULAR FORMULA: C19H15NO2S
MOLECULAR WEIGHT: 321.3929
SMILES: CC(=O)C1=C(SC(=C1)C(=O)C2=CC=CC=C2)NC3=CC=CC=C3
Structure:
CAS RN: 5670-60-0
CAS Name: (3Z)-5-(4-bromophenyl)-3-(thiophen-2-ylmethylidene)-2-furanone
OPENEYE Name: (3Z)-5-(4-bromophenyl)-3-(2-thienylmethylene)furan-2-one
IUPAC Name: (3Z)-5-(4-bromophenyl)-3-(thiophen-2-ylmethylidene)furan-2-one
SYSTEMATIC NAME: (3Z)-5-(4-bromophenyl)-3-(thiophen-2-ylmethylidene)furan-2-one
MOLECULAR FORMULA: C15H9BrO2S
MOLECULAR WEIGHT: 333.19976
SMILES: C1=CSC(=C1)/C=C\2/C=C(OC2=O)C3=CC=C(C=C3)Br
Structure:
CAS RN: 5669-37-4
CAS Name: (3-anilino-5-methyl-1-pyrazolyl)-(4-chlorophenyl)methanone
OPENEYE Name: (3-anilino-5-methyl-pyrazol-1-yl)-(4-chlorophenyl)methanone
IUPAC Name: (3-anilino-5-methylpyrazol-1-yl)-(4-chlorophenyl)methanone
SYSTEMATIC NAME: (4-chlorophenyl)-(5-methyl-3-phenylazanyl-pyrazol-1-yl)methanone
MOLECULAR FORMULA: C17H14ClN3O
MOLECULAR WEIGHT: 311.76556
SMILES: CC1=CC(=NN1C(=O)C2=CC=C(C=C2)Cl)NC3=CC=CC=C3
Structure:
CAS RN: 5666-61-5
CAS Name: 5-phenyl-2-[[(phenylmethyl)amino]methylidene]cyclohexane-1,3-dione
OPENEYE Name: 2-[(benzylamino)methylene]-5-phenyl-cyclohexane-1,3-dione
IUPAC Name: 2-[(benzylamino)methylidene]-5-phenylcyclohexane-1,3-dione
SYSTEMATIC NAME: 5-phenyl-2-[[(phenylmethyl)amino]methylidene]cyclohexane-1,3-dione
MOLECULAR FORMULA: C20H19NO2
MOLECULAR WEIGHT: 305.37036
SMILES: C1C(CC(=O)C(=CNCC2=CC=CC=C2)C1=O)C3=CC=CC=C3
Structure:
CAS RN: 5664-73-3
CAS Name: 2-(4-hydroxyphenyl)benzo[f]isoindole-1,3-dione
OPENEYE Name: 2-(4-hydroxyphenyl)benzo[f]isoindole-1,3-dione
IUPAC Name: 2-(4-hydroxyphenyl)benzo[f]isoindole-1,3-dione
SYSTEMATIC NAME: 2-(4-hydroxyphenyl)benzo[f]isoindole-1,3-dione
MOLECULAR FORMULA: C18H11NO3
MOLECULAR WEIGHT: 289.28484
SMILES: C1=CC=C2C=C3C(=CC2=C1)C(=O)N(C3=O)C4=CC=C(C=C4)O
Structure:
CAS RN: 5662-69-1
CAS Name: 2-methyl-4-phenyl-1H-quinolin-7-one
OPENEYE Name: 2-methyl-4-phenyl-1H-quinolin-7-one
IUPAC Name: 2-methyl-4-phenyl-1H-quinolin-7-one
SYSTEMATIC NAME: 2-methyl-4-phenyl-1H-quinolin-7-one
MOLECULAR FORMULA: C16H13NO
MOLECULAR WEIGHT: 235.28052
SMILES: CC1=CC(=C2C=CC(=O)C=C2N1)C3=CC=CC=C3
Structure:
CAS RN: 5662-41-9
CAS Name: N-(3-methylphenyl)-4-thiophen-2-yl-2-thiazolamine
OPENEYE Name: N-(m-tolyl)-4-(2-thienyl)thiazol-2-amine
IUPAC Name: N-(3-methylphenyl)-4-thiophen-2-yl-1,3-thiazol-2-amine
SYSTEMATIC NAME: N-(3-methylphenyl)-4-thiophen-2-yl-1,3-thiazol-2-amine
MOLECULAR FORMULA: C14H12N2S2
MOLECULAR WEIGHT: 272.38848
SMILES: CC1=CC(=CC=C1)NC2=NC(=CS2)C3=CC=CS3
Structure:
CAS RN: 5661-62-1
CAS Name: 3-chloro-N,N-dimethyl-1-benzothiophene-2-carboxamide
OPENEYE Name: 3-chloro-N,N-dimethyl-benzothiophene-2-carboxamide
IUPAC Name: 3-chloro-N,N-dimethyl-1-benzothiophene-2-carboxamide
SYSTEMATIC NAME: 3-chloranyl-N,N-dimethyl-1-benzothiophene-2-carboxamide
MOLECULAR FORMULA: C11H10ClNOS
MOLECULAR WEIGHT: 239.7212
SMILES: CN(C)C(=O)C1=C(C2=CC=CC=C2S1)Cl
Structure:
CAS RN: 5473-22-3
CAS Name: N-[3-(4-chlorophenyl)-1-phenyl-2,4-dihydro-1,3,5-triazin-6-yl]nitramide
OPENEYE Name: N-[3-(4-chlorophenyl)-1-phenyl-2,4-dihydro-1,3,5-triazin-6-yl]nitramide
IUPAC Name: N-[3-(4-chlorophenyl)-1-phenyl-2,4-dihydro-1,3,5-triazin-6-yl]nitramide
SYSTEMATIC NAME: N-[3-(4-chlorophenyl)-1-phenyl-2,4-dihydro-1,3,5-triazin-6-yl]nitramide
MOLECULAR FORMULA: C15H14ClN5O2
MOLECULAR WEIGHT: 331.75696
SMILES: C1N=C(N(CN1C2=CC=C(C=C2)Cl)C3=CC=CC=C3)N[N+](=O)[O-]
Structure:
CAS RN: 5472-70-8
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C20H18N2O2
MOLECULAR WEIGHT: 318.36912
SMILES: C1CCC(CC1)NC2=C3C4=C(C5=CC=CC=C5C3=O)ON=C4C=C2
Structure:
CAS RN: 5471-95-4
CAS Name: 2-phenyl-4-benzo[g][3,1]benzoxazinone
OPENEYE Name: 2-phenylbenzo[g][3,1]benzoxazin-4-one
IUPAC Name: 2-phenylbenzo[g][3,1]benzoxazin-4-one
SYSTEMATIC NAME: 2-phenylbenzo[g][3,1]benzoxazin-4-one
MOLECULAR FORMULA: C18H11NO2
MOLECULAR WEIGHT: 273.28544
SMILES: C1=CC=C(C=C1)C2=NC3=CC4=CC=CC=C4C=C3C(=O)O2
Structure:
CAS RN: 6622-95-3
CAS Name: acetic acid [2-methoxy-4-[(E)-2-nitroethenyl]phenyl] ester
OPENEYE Name: [2-methoxy-4-[(E)-2-nitrovinyl]phenyl] acetate
IUPAC Name: [2-methoxy-4-[(E)-2-nitroethenyl]phenyl] acetate
SYSTEMATIC NAME: [2-methoxy-4-[(E)-2-nitroethenyl]phenyl] ethanoate
MOLECULAR FORMULA: C11H11NO5
MOLECULAR WEIGHT: 237.20874
SMILES: CC(=O)OC1=C(C=C(C=C1)/C=C/[N+](=O)[O-])OC
Structure:
CAS RN: 5842-85-3
CAS Name: (4E)-4-[(2,5-dimethoxyphenyl)methylidene]-2-[(E)-2-phenylethenyl]-5-oxazolone
OPENEYE Name: (4E)-4-[(2,5-dimethoxyphenyl)methylene]-2-[(E)-styryl]oxazol-5-one
IUPAC Name: (4E)-4-[(2,5-dimethoxyphenyl)methylidene]-2-[(E)-2-phenylethenyl]-1,3-oxazol-5-one
SYSTEMATIC NAME: (4E)-4-[(2,5-dimethoxyphenyl)methylidene]-2-[(E)-2-phenylethenyl]-1,3-oxazol-5-one
MOLECULAR FORMULA: C20H17NO4
MOLECULAR WEIGHT: 335.35328
SMILES: COC1=CC(=C(C=C1)OC)/C=C/2\C(=O)OC(=N2)/C=C/C3=CC=CC=C3
Structure:
CAS RN: 5799-85-9
CAS Name: 5-(3-nitrophenyl)-3-(2-pyridinyl)-1,2,4-oxadiazole
OPENEYE Name: 5-(3-nitrophenyl)-3-(2-pyridyl)-1,2,4-oxadiazole
IUPAC Name: 5-(3-nitrophenyl)-3-pyridin-2-yl-1,2,4-oxadiazole
SYSTEMATIC NAME: 5-(3-nitrophenyl)-3-pyridin-2-yl-1,2,4-oxadiazole
MOLECULAR FORMULA: C13H8N4O3
MOLECULAR WEIGHT: 268.22762
SMILES: C1=CC=NC(=C1)C2=NOC(=N2)C3=CC(=CC=C3)[N+](=O)[O-]
Structure:
CAS RN: 6253-71-0
CAS Name: 3-(trifluoromethyl)benzoic acid (4-oxo-1,2,3-benzotriazin-3-yl)methyl ester
OPENEYE Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 3-(trifluoromethyl)benzoate
IUPAC Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 3-(trifluoromethyl)benzoate
SYSTEMATIC NAME: (4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl 3-(trifluoromethyl)benzoate
MOLECULAR FORMULA: C16H10F3N3O3
MOLECULAR WEIGHT: 349.26411
SMILES: C1=CC=C2C(=C1)C(=O)N(N=N2)COC(=O)C3=CC(=CC=C3)C(F)(F)F
Structure:
CAS RN: 6242-76-8
CAS Name: N-(2,3-dimethylphenyl)-2-[(1-phenyl-2-imidazolyl)thio]acetamide
OPENEYE Name: N-(2,3-dimethylphenyl)-2-(1-phenylimidazol-2-yl)sulfanyl-acetamide
IUPAC Name: N-(2,3-dimethylphenyl)-2-(1-phenylimidazol-2-yl)sulfanylacetamide
SYSTEMATIC NAME: N-(2,3-dimethylphenyl)-2-(1-phenylimidazol-2-yl)sulfanyl-ethanamide
MOLECULAR FORMULA: C19H19N3OS
MOLECULAR WEIGHT: 337.43866
SMILES: CC1=C(C(=CC=C1)NC(=O)CSC2=NC=CN2C3=CC=CC=C3)C
Structure:
CAS RN: 57036-88-1
CAS Name: (4-amino-3-phenyl-2-sulfanylidene-5-thiazolyl)-(4-morpholinyl)methanone
OPENEYE Name: (4-amino-3-phenyl-2-thioxo-thiazol-5-yl)-morpholino-methanone
IUPAC Name: (4-amino-3-phenyl-2-sulfanylidene-1,3-thiazol-5-yl)-morpholin-4-ylmethanone
SYSTEMATIC NAME: (4-azanyl-3-phenyl-2-sulfanylidene-1,3-thiazol-5-yl)-morpholin-4-yl-methanone
MOLECULAR FORMULA: C14H15N3O2S2
MOLECULAR WEIGHT: 321.4178
SMILES: C1COCCN1C(=O)C2=C(N(C(=S)S2)C3=CC=CC=C3)N
Structure:
CAS RN: 57036-89-2
CAS Name: (4-amino-3-phenyl-2-sulfanylidene-5-thiazolyl)-(1-piperidinyl)methanone
OPENEYE Name: (4-amino-3-phenyl-2-thioxo-thiazol-5-yl)-(1-piperidyl)methanone
IUPAC Name: (4-amino-3-phenyl-2-sulfanylidene-1,3-thiazol-5-yl)-piperidin-1-ylmethanone
SYSTEMATIC NAME: (4-azanyl-3-phenyl-2-sulfanylidene-1,3-thiazol-5-yl)-piperidin-1-yl-methanone
MOLECULAR FORMULA: C15H17N3OS2
MOLECULAR WEIGHT: 319.44498
SMILES: C1CCN(CC1)C(=O)C2=C(N(C(=S)S2)C3=CC=CC=C3)N
Structure:
CAS RN: 35696-83-4
CAS Name: 4-anilino-1H-quinazoline-2-thione
OPENEYE Name: 4-anilino-1H-quinazoline-2-thione
IUPAC Name: 4-anilino-1H-quinazoline-2-thione
SYSTEMATIC NAME: 4-phenylazanyl-1H-quinazoline-2-thione
MOLECULAR FORMULA: C14H11N3S
MOLECULAR WEIGHT: 253.32224
SMILES: C1=CC=C(C=C1)NC2=NC(=S)NC3=CC=CC=C32
Structure:
CAS RN: 4210-51-9
CAS Name: 3-(2-pyridinylmethyl)-2-sulfanylidene-1H-quinazolin-4-one
OPENEYE Name: 3-(2-pyridylmethyl)-2-thioxo-1H-quinazolin-4-one
IUPAC Name: 3-(pyridin-2-ylmethyl)-2-sulfanylidene-1H-quinazolin-4-one
SYSTEMATIC NAME: 3-(pyridin-2-ylmethyl)-2-sulfanylidene-1H-quinazolin-4-one
MOLECULAR FORMULA: C14H11N3OS
MOLECULAR WEIGHT: 269.32164
SMILES: C1=CC=C2C(=C1)C(=O)N(C(=S)N2)CC3=CC=CC=N3
Structure:
CAS RN: 5122-43-0
CAS Name: 4-[2-[[5-(2-methylphenyl)-1,3,4-oxadiazol-2-yl]thio]ethyl]morpholine
OPENEYE Name: 4-[2-[[5-(o-tolyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethyl]morpholine
IUPAC Name: 4-[2-[[5-(2-methylphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethyl]morpholine
SYSTEMATIC NAME: 4-[2-[[5-(2-methylphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethyl]morpholine
MOLECULAR FORMULA: C15H19N3O2S
MOLECULAR WEIGHT: 305.39526
SMILES: CC1=CC=CC=C1C2=NN=C(O2)SCCN3CCOCC3
Structure:
CAS RN: 15182-67-9
CAS Name: 1-(2-methoxyphenyl)-2H-tetrazole-5-thione
OPENEYE Name: 1-(2-methoxyphenyl)-2H-tetrazole-5-thione
IUPAC Name: 1-(2-methoxyphenyl)-2H-tetrazole-5-thione
SYSTEMATIC NAME: 1-(2-methoxyphenyl)-2H-1,2,3,4-tetrazole-5-thione
MOLECULAR FORMULA: C8H8N4OS
MOLECULAR WEIGHT: 208.24032
SMILES: COC1=CC=CC=C1N2C(=S)N=NN2
Structure:
CAS RN: 63224-31-7
CAS Name: 1-[[2-furanyl(oxo)methyl]amino]-3-(phenylmethyl)thiourea
OPENEYE Name: 1-benzyl-3-(furan-2-carbonylamino)thiourea
IUPAC Name: 1-benzyl-3-(furan-2-carbonylamino)thiourea
SYSTEMATIC NAME: 1-(furan-2-ylcarbonylamino)-3-(phenylmethyl)thiourea
MOLECULAR FORMULA: C13H13N3O2S
MOLECULAR WEIGHT: 275.32622
SMILES: C1=CC=C(C=C1)CNC(=S)NNC(=O)C2=CC=CO2
Structure:
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