Wednesday, June 27, 2012

All Chemical Compounds Information




Product OPENEYE NAME:
CAS Name:
IUPAC NAME:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C20H15N3
MOLECULAR WEIGHT: 297.3532
SMILES: C1C2=CC=CC=C2N3C=CC=C3C4=NC=C(N41)C5=CC=CC=C5
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Product OPENEYE NAME: 4-iodo-1-(4-nitrophenyl)pyrazole
CAS Name: 4-iodo-1-(4-nitrophenyl)pyrazole
IUPAC NAME: 4-iodo-1-(4-nitrophenyl)pyrazole
SYSTEMATIC NAME: 4-iodanyl-1-(4-nitrophenyl)pyrazole
MOLECULAR FORMULA: C9H6IN3O2
MOLECULAR WEIGHT: 315.06731
SMILES: C1=CC(=CC=C1N2C=C(C=N2)I)[N+](=O)[O-]
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Product OPENEYE NAME: 4-[2-(4-methoxyphenyl)ethynyl]-1-(4-nitrophenyl)pyrazole
CAS Name: 4-[2-(4-methoxyphenyl)ethynyl]-1-(4-nitrophenyl)pyrazole
IUPAC NAME: 4-[2-(4-methoxyphenyl)ethynyl]-1-(4-nitrophenyl)pyrazole
SYSTEMATIC NAME: 4-[2-(4-methoxyphenyl)ethynyl]-1-(4-nitrophenyl)pyrazole
MOLECULAR FORMULA: C18H13N3O3
MOLECULAR WEIGHT: 319.31412
SMILES: COC1=CC=C(C=C1)C#CC2=CN(N=C2)C3=CC=C(C=C3)[N+](=O)[O-]
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Product OPENEYE NAME: 4-[(E)-2-(4-methoxyphenyl)vinyl]-1-(4-nitrophenyl)pyrazole
CAS Name: 4-[(E)-2-(4-methoxyphenyl)ethenyl]-1-(4-nitrophenyl)pyrazole
IUPAC NAME: 4-[(E)-2-(4-methoxyphenyl)ethenyl]-1-(4-nitrophenyl)pyrazole
SYSTEMATIC NAME: 4-[(E)-2-(4-methoxyphenyl)ethenyl]-1-(4-nitrophenyl)pyrazole
MOLECULAR FORMULA: C18H15N3O3
MOLECULAR WEIGHT: 321.33
SMILES: COC1=CC=C(C=C1)/C=C/C2=CN(N=C2)C3=CC=C(C=C3)[N+](=O)[O-]
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Product OPENEYE NAME: (E)-3-(4-methylsulfanylphenyl)prop-2-enoyl chloride
CAS Name: (E)-3-[4-(methylthio)phenyl]-2-propenoyl chloride
IUPAC NAME: (E)-3-(4-methylsulfanylphenyl)prop-2-enoyl chloride
SYSTEMATIC NAME: (E)-3-(4-methylsulfanylphenyl)prop-2-enoyl chloride
MOLECULAR FORMULA: C10H9ClOS
MOLECULAR WEIGHT: 212.69586
SMILES: CSC1=CC=C(C=C1)/C=C/C(=O)Cl
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Product OPENEYE NAME: (E)-1-(4-methoxyphenyl)-5-trimethylsilyl-pent-1-en-4-yn-3-one
CAS Name: (E)-1-(4-methoxyphenyl)-5-trimethylsilyl-3-pent-1-en-4-ynone
IUPAC NAME: (E)-1-(4-methoxyphenyl)-5-trimethylsilylpent-1-en-4-yn-3-one
SYSTEMATIC NAME: (E)-1-(4-methoxyphenyl)-5-trimethylsilyl-pent-1-en-4-yn-3-one
MOLECULAR FORMULA: C15H18O2Si
MOLECULAR WEIGHT: 258.38772
SMILES: COC1=CC=C(C=C1)/C=C/C(=O)C#C[Si](C)(C)C
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Product OPENEYE NAME: (E)-1-(4-methylsulfanylphenyl)-5-trimethylsilyl-pent-1-en-4-yn-3-one
CAS Name: (E)-1-[4-(methylthio)phenyl]-5-trimethylsilyl-3-pent-1-en-4-ynone
IUPAC NAME: (E)-1-(4-methylsulfanylphenyl)-5-trimethylsilylpent-1-en-4-yn-3-one
SYSTEMATIC NAME: (E)-1-(4-methylsulfanylphenyl)-5-trimethylsilyl-pent-1-en-4-yn-3-one
MOLECULAR FORMULA: C15H18OSSi
MOLECULAR WEIGHT: 274.45332
SMILES: C[Si](C)(C)C#CC(=O)/C=C/C1=CC=C(C=C1)SC
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Product OPENEYE NAME: (E)-1-(4-nitrophenyl)-5-trimethylsilyl-pent-1-en-4-yn-3-one
CAS Name: (E)-1-(4-nitrophenyl)-5-trimethylsilyl-3-pent-1-en-4-ynone
IUPAC NAME: (E)-1-(4-nitrophenyl)-5-trimethylsilylpent-1-en-4-yn-3-one
SYSTEMATIC NAME: (E)-1-(4-nitrophenyl)-5-trimethylsilyl-pent-1-en-4-yn-3-one
MOLECULAR FORMULA: C14H15NO3Si
MOLECULAR WEIGHT: 273.3593
SMILES: C[Si](C)(C)C#CC(=O)/C=C/C1=CC=C(C=C1)[N+](=O)[O-]
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Product OPENEYE NAME: (E)-1-(4-methoxyphenyl)pent-1-en-4-yn-3-one
CAS Name: (E)-1-(4-methoxyphenyl)-3-pent-1-en-4-ynone
IUPAC NAME: (E)-1-(4-methoxyphenyl)pent-1-en-4-yn-3-one
SYSTEMATIC NAME: (E)-1-(4-methoxyphenyl)pent-1-en-4-yn-3-one
MOLECULAR FORMULA: C12H10O2
MOLECULAR WEIGHT: 186.2066
SMILES: COC1=CC=C(C=C1)/C=C/C(=O)C#C
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Product OPENEYE NAME: (E)-1-(4-methylsulfanylphenyl)pent-1-en-4-yn-3-one
CAS Name: (E)-1-[4-(methylthio)phenyl]-3-pent-1-en-4-ynone
IUPAC NAME: (E)-1-(4-methylsulfanylphenyl)pent-1-en-4-yn-3-one
SYSTEMATIC NAME: (E)-1-(4-methylsulfanylphenyl)pent-1-en-4-yn-3-one
MOLECULAR FORMULA: C12H10OS
MOLECULAR WEIGHT: 202.2722
SMILES: CSC1=CC=C(C=C1)/C=C/C(=O)C#C
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Product OPENEYE NAME: (E)-1-(4-nitrophenyl)pent-1-en-4-yn-3-one
CAS Name: (E)-1-(4-nitrophenyl)-3-pent-1-en-4-ynone
IUPAC NAME: (E)-1-(4-nitrophenyl)pent-1-en-4-yn-3-one
SYSTEMATIC NAME: (E)-1-(4-nitrophenyl)pent-1-en-4-yn-3-one
MOLECULAR FORMULA: C11H7NO3
MOLECULAR WEIGHT: 201.17818
SMILES: C#CC(=O)/C=C/C1=CC=C(C=C1)[N+](=O)[O-]
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Product OPENEYE NAME: 1-(4-nitrophenyl)-3-[(E)-styryl]pyrazole
CAS Name: 1-(4-nitrophenyl)-3-[(E)-2-phenylethenyl]pyrazole
IUPAC NAME: 1-(4-nitrophenyl)-3-[(E)-2-phenylethenyl]pyrazole
SYSTEMATIC NAME: 1-(4-nitrophenyl)-3-[(E)-2-phenylethenyl]pyrazole
MOLECULAR FORMULA: C17H13N3O2
MOLECULAR WEIGHT: 291.30402
SMILES: C1=CC=C(C=C1)/C=C/C2=NN(C=C2)C3=CC=C(C=C3)[N+](=O)[O-]
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Product OPENEYE NAME: 3-[(E)-2-(4-methoxyphenyl)vinyl]-1-(4-nitrophenyl)pyrazole
CAS Name: 3-[(E)-2-(4-methoxyphenyl)ethenyl]-1-(4-nitrophenyl)pyrazole
IUPAC NAME: 3-[(E)-2-(4-methoxyphenyl)ethenyl]-1-(4-nitrophenyl)pyrazole
SYSTEMATIC NAME: 3-[(E)-2-(4-methoxyphenyl)ethenyl]-1-(4-nitrophenyl)pyrazole
MOLECULAR FORMULA: C18H15N3O3
MOLECULAR WEIGHT: 321.33
SMILES: COC1=CC=C(C=C1)/C=C/C2=NN(C=C2)C3=CC=C(C=C3)[N+](=O)[O-]
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Product OPENEYE NAME: 1-(2,4-dinitrophenyl)-3-[(E)-2-(4-methoxyphenyl)vinyl]pyrazole
CAS Name: 1-(2,4-dinitrophenyl)-3-[(E)-2-(4-methoxyphenyl)ethenyl]pyrazole
IUPAC NAME: 1-(2,4-dinitrophenyl)-3-[(E)-2-(4-methoxyphenyl)ethenyl]pyrazole
SYSTEMATIC NAME: 1-(2,4-dinitrophenyl)-3-[(E)-2-(4-methoxyphenyl)ethenyl]pyrazole
MOLECULAR FORMULA: C18H14N4O5
MOLECULAR WEIGHT: 366.32756
SMILES: COC1=CC=C(C=C1)/C=C/C2=NN(C=C2)C3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]
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Product OPENEYE NAME: 3-[(E)-2-(4-methoxyphenyl)vinyl]-1-(4-methylsulfonylphenyl)pyrazole
CAS Name: 3-[(E)-2-(4-methoxyphenyl)ethenyl]-1-(4-methylsulfonylphenyl)pyrazole
IUPAC NAME: 3-[(E)-2-(4-methoxyphenyl)ethenyl]-1-(4-methylsulfonylphenyl)pyrazole
SYSTEMATIC NAME: 3-[(E)-2-(4-methoxyphenyl)ethenyl]-1-(4-methylsulfonylphenyl)pyrazole
MOLECULAR FORMULA: C19H18N2O3S
MOLECULAR WEIGHT: 354.42282
SMILES: COC1=CC=C(C=C1)/C=C/C2=NN(C=C2)C3=CC=C(C=C3)S(=O)(=O)C
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Product OPENEYE NAME: 3-[(E)-2-(4-methylsulfanylphenyl)vinyl]-1-(4-nitrophenyl)pyrazole
CAS Name: 3-[(E)-2-[4-(methylthio)phenyl]ethenyl]-1-(4-nitrophenyl)pyrazole
IUPAC NAME: 3-[(E)-2-(4-methylsulfanylphenyl)ethenyl]-1-(4-nitrophenyl)pyrazole
SYSTEMATIC NAME: 3-[(E)-2-(4-methylsulfanylphenyl)ethenyl]-1-(4-nitrophenyl)pyrazole
MOLECULAR FORMULA: C18H15N3O2S
MOLECULAR WEIGHT: 337.3956
SMILES: CSC1=CC=C(C=C1)/C=C/C2=NN(C=C2)C3=CC=C(C=C3)[N+](=O)[O-]
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Product OPENEYE NAME: 1-(4-methoxyphenyl)-3-[(E)-2-(4-nitrophenyl)vinyl]pyrazole
CAS Name: 1-(4-methoxyphenyl)-3-[(E)-2-(4-nitrophenyl)ethenyl]pyrazole
IUPAC NAME: 1-(4-methoxyphenyl)-3-[(E)-2-(4-nitrophenyl)ethenyl]pyrazole
SYSTEMATIC NAME: 1-(4-methoxyphenyl)-3-[(E)-2-(4-nitrophenyl)ethenyl]pyrazole
MOLECULAR FORMULA: C18H15N3O3
MOLECULAR WEIGHT: 321.33
SMILES: COC1=CC=C(C=C1)N2C=CC(=N2)/C=C/C3=CC=C(C=C3)[N+](=O)[O-]
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Product OPENEYE NAME: 1-(4-nitrophenyl)-5-[(E)-styryl]pyrazole
CAS Name: 1-(4-nitrophenyl)-5-[(E)-2-phenylethenyl]pyrazole
IUPAC NAME: 1-(4-nitrophenyl)-5-[(E)-2-phenylethenyl]pyrazole
SYSTEMATIC NAME: 1-(4-nitrophenyl)-5-[(E)-2-phenylethenyl]pyrazole
MOLECULAR FORMULA: C17H13N3O2
MOLECULAR WEIGHT: 291.30402
SMILES: C1=CC=C(C=C1)/C=C/C2=CC=NN2C3=CC=C(C=C3)[N+](=O)[O-]
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Product OPENEYE NAME: 5-[(E)-2-(4-methoxyphenyl)vinyl]-1-(4-nitrophenyl)pyrazole
CAS Name: 5-[(E)-2-(4-methoxyphenyl)ethenyl]-1-(4-nitrophenyl)pyrazole
IUPAC NAME: 5-[(E)-2-(4-methoxyphenyl)ethenyl]-1-(4-nitrophenyl)pyrazole
SYSTEMATIC NAME: 5-[(E)-2-(4-methoxyphenyl)ethenyl]-1-(4-nitrophenyl)pyrazole
MOLECULAR FORMULA: C18H15N3O3
MOLECULAR WEIGHT: 321.33
SMILES: COC1=CC=C(C=C1)/C=C/C2=CC=NN2C3=CC=C(C=C3)[N+](=O)[O-]
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Product OPENEYE NAME: 1-(2,4-dinitrophenyl)-5-[(E)-2-(4-methoxyphenyl)vinyl]pyrazole
CAS Name: 1-(2,4-dinitrophenyl)-5-[(E)-2-(4-methoxyphenyl)ethenyl]pyrazole
IUPAC NAME: 1-(2,4-dinitrophenyl)-5-[(E)-2-(4-methoxyphenyl)ethenyl]pyrazole
SYSTEMATIC NAME: 1-(2,4-dinitrophenyl)-5-[(E)-2-(4-methoxyphenyl)ethenyl]pyrazole
MOLECULAR FORMULA: C18H14N4O5
MOLECULAR WEIGHT: 366.32756
SMILES: COC1=CC=C(C=C1)/C=C/C2=CC=NN2C3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]
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Product OPENEYE NAME: 5-[(E)-2-(4-methoxyphenyl)vinyl]-1-(4-methylsulfonylphenyl)pyrazole
CAS Name: 5-[(E)-2-(4-methoxyphenyl)ethenyl]-1-(4-methylsulfonylphenyl)pyrazole
IUPAC NAME: 5-[(E)-2-(4-methoxyphenyl)ethenyl]-1-(4-methylsulfonylphenyl)pyrazole
SYSTEMATIC NAME: 5-[(E)-2-(4-methoxyphenyl)ethenyl]-1-(4-methylsulfonylphenyl)pyrazole
MOLECULAR FORMULA: C19H18N2O3S
MOLECULAR WEIGHT: 354.42282
SMILES: COC1=CC=C(C=C1)/C=C/C2=CC=NN2C3=CC=C(C=C3)S(=O)(=O)C
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Product OPENEYE NAME: 5-[(E)-2-(4-methylsulfanylphenyl)vinyl]-1-(4-nitrophenyl)pyrazole
CAS Name: 5-[(E)-2-[4-(methylthio)phenyl]ethenyl]-1-(4-nitrophenyl)pyrazole
IUPAC NAME: 5-[(E)-2-(4-methylsulfanylphenyl)ethenyl]-1-(4-nitrophenyl)pyrazole
SYSTEMATIC NAME: 5-[(E)-2-(4-methylsulfanylphenyl)ethenyl]-1-(4-nitrophenyl)pyrazole
MOLECULAR FORMULA: C18H15N3O2S
MOLECULAR WEIGHT: 337.3956
SMILES: CSC1=CC=C(C=C1)/C=C/C2=CC=NN2C3=CC=C(C=C3)[N+](=O)[O-]
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