Product OPENEYE NAME: N-[1-(1,3-benzodioxol-5-yl)ethyl]-2-methyl-propan-1-amine
CAS Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-2-methyl-1-propanamine
IUPAC NAME: N-[1-(1,3-benzodioxol-5-yl)ethyl]-2-methylpropan-1-amine
SYSTEMATIC NAME: N-[1-(1,3-benzodioxol-5-yl)ethyl]-2-methyl-propan-1-amine
MOLECULAR FORMULA: C13H19NO2
MOLECULAR WEIGHT: 221.29546
SMILES: CC(C)CNC(C)C1=CC2=C(C=C1)OCO2
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Product OPENEYE NAME: 1-nitro-4-[(1E,5E)-6-(4-nitrophenyl)hexa-1,5-dienyl]benzene
CAS Name: 1-nitro-4-[(1E,5E)-6-(4-nitrophenyl)hexa-1,5-dienyl]benzene
IUPAC NAME: 1-nitro-4-[(1E,5E)-6-(4-nitrophenyl)hexa-1,5-dienyl]benzene
SYSTEMATIC NAME: 1-nitro-4-[(1E,5E)-6-(4-nitrophenyl)hexa-1,5-dienyl]benzene
MOLECULAR FORMULA: C18H16N2O4
MOLECULAR WEIGHT: 324.33064
SMILES: C1=CC(=CC=C1/C=C/CC/C=C/C2=CC=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]
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Product OPENEYE NAME: 4-[6-(4-aminophenyl)hexyl]aniline
CAS Name: 4-[6-(4-aminophenyl)hexyl]aniline
IUPAC NAME: 4-[6-(4-aminophenyl)hexyl]aniline
SYSTEMATIC NAME: 4-[6-(4-aminophenyl)hexyl]aniline
MOLECULAR FORMULA: C18H24N2
MOLECULAR WEIGHT: 268.39656
SMILES: C1=CC(=CC=C1CCCCCCC2=CC=C(C=C2)N)N
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Product OPENEYE NAME: N-[4-[6-[4-(4,5-dihydro-1H-imidazol-2-ylamino)phenyl]hexyl]phenyl]-4,5-dihydro-1H-imidazol-2-amine
CAS Name: N-[4-[6-[4-(4,5-dihydro-1H-imidazol-2-ylamino)phenyl]hexyl]phenyl]-4,5-dihydro-1H-imidazol-2-amine
IUPAC NAME: N-[4-[6-[4-(4,5-dihydro-1H-imidazol-2-ylamino)phenyl]hexyl]phenyl]-4,5-dihydro-1H-imidazol-2-amine
SYSTEMATIC NAME: N-[4-[6-[4-(4,5-dihydro-1H-imidazol-2-ylamino)phenyl]hexyl]phenyl]-4,5-dihydro-1H-imidazol-2-amine
MOLECULAR FORMULA: C24H32N6
MOLECULAR WEIGHT: 404.55108
SMILES: C1CN=C(N1)NC2=CC=C(C=C2)CCCCCCC3=CC=C(C=C3)NC4=NCCN4
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Product OPENEYE NAME: (5,8-dioxo-1,4,4a,6,7,8a-hexahydronaphthalen-1-yl) acetate
CAS Name: acetic acid (5,8-dioxo-1,4,4a,6,7,8a-hexahydronaphthalen-1-yl) ester
IUPAC NAME: (5,8-dioxo-1,4,4a,6,7,8a-hexahydronaphthalen-1-yl) acetate
SYSTEMATIC NAME: [5,8-bis(oxidanylidene)-1,4,4a,6,7,8a-hexahydronaphthalen-1-yl] ethanoate
MOLECULAR FORMULA: C12H14O4
MOLECULAR WEIGHT: 222.23716
SMILES: CC(=O)OC1C=CCC2C1C(=O)CCC2=O
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Product OPENEYE NAME: [(1S,4aR,8aR)-5,8-dioxo-1,4,4a,6,7,8a-hexahydronaphthalen-1-yl] acetate
CAS Name: acetic acid [(1S,4aR,8aR)-5,8-dioxo-1,4,4a,6,7,8a-hexahydronaphthalen-1-yl] ester
IUPAC NAME: [(1S,4aR,8aR)-5,8-dioxo-1,4,4a,6,7,8a-hexahydronaphthalen-1-yl] acetate
SYSTEMATIC NAME: [(1S,4aR,8aR)-5,8-bis(oxidanylidene)-1,4,4a,6,7,8a-hexahydronaphthalen-1-yl] ethanoate
MOLECULAR FORMULA: C12H14O4
MOLECULAR WEIGHT: 222.23716
SMILES: CC(=O)O[C@H]1C=CC[C@@H]2[C@H]1C(=O)CCC2=O
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Product OPENEYE NAME: 1-[2-(dimethylaminoazo)phenyl]sulfonyl-3-(4-methoxy-6-methyl-pyrimidin-2-yl)urea
CAS Name: 1-[2-(dimethylaminoazo)phenyl]sulfonyl-3-(4-methoxy-6-methyl-2-pyrimidinyl)urea
IUPAC NAME: 1-[2-(dimethylaminodiazenyl)phenyl]sulfonyl-3-(4-methoxy-6-methylpyrimidin-2-yl)urea
SYSTEMATIC NAME: 1-[2-(dimethylaminodiazenyl)phenyl]sulfonyl-3-(4-methoxy-6-methyl-pyrimidin-2-yl)urea
MOLECULAR FORMULA: C15H19N7O4S
MOLECULAR WEIGHT: 393.42086
SMILES: CC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)C2=CC=CC=C2N=NN(C)C)OC
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Product OPENEYE NAME: N-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]-3-nitro-1H-pyrrol-2-amine
CAS Name: N-[2-[(5-methyl-1H-imidazol-4-yl)methylthio]ethyl]-3-nitro-1H-pyrrol-2-amine
IUPAC NAME: N-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]-3-nitro-1H-pyrrol-2-amine
SYSTEMATIC NAME: N-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]-3-nitro-1H-pyrrol-2-amine
MOLECULAR FORMULA: C11H15N5O2S
MOLECULAR WEIGHT: 281.3341
SMILES: CC1=C(N=CN1)CSCCNC2=C(C=CN2)[N+](=O)[O-]
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Product OPENEYE NAME: 4-methyl-N-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]-3-nitro-1H-pyrrol-2-amine
CAS Name: 4-methyl-N-[2-[(5-methyl-1H-imidazol-4-yl)methylthio]ethyl]-3-nitro-1H-pyrrol-2-amine
IUPAC NAME: 4-methyl-N-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]-3-nitro-1H-pyrrol-2-amine
SYSTEMATIC NAME: 4-methyl-N-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]-3-nitro-1H-pyrrol-2-amine
MOLECULAR FORMULA: C12H17N5O2S
MOLECULAR WEIGHT: 295.36068
SMILES: CC1=CNC(=C1[N+](=O)[O-])NCCSCC2=C(NC=N2)C
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Product OPENEYE NAME: 4-benzyl-N-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]-3-nitro-1H-pyrrol-2-amine
CAS Name: N-[2-[(5-methyl-1H-imidazol-4-yl)methylthio]ethyl]-3-nitro-4-(phenylmethyl)-1H-pyrrol-2-amine
IUPAC NAME: 4-benzyl-N-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]-3-nitro-1H-pyrrol-2-amine
SYSTEMATIC NAME: N-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]-3-nitro-4-(phenylmethyl)-1H-pyrrol-2-amine
MOLECULAR FORMULA: C18H21N5O2S
MOLECULAR WEIGHT: 371.45664
SMILES: CC1=C(N=CN1)CSCCNC2=C(C(=CN2)CC3=CC=CC=C3)[N+](=O)[O-]
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Product OPENEYE NAME: N-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]-3-nitro-4-phenyl-1H-pyrrol-2-amine
CAS Name: N-[2-[(5-methyl-1H-imidazol-4-yl)methylthio]ethyl]-3-nitro-4-phenyl-1H-pyrrol-2-amine
IUPAC NAME: N-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]-3-nitro-4-phenyl-1H-pyrrol-2-amine
SYSTEMATIC NAME: N-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]-3-nitro-4-phenyl-1H-pyrrol-2-amine
MOLECULAR FORMULA: C17H19N5O2S
MOLECULAR WEIGHT: 357.43006
SMILES: CC1=C(N=CN1)CSCCNC2=C(C(=CN2)C3=CC=CC=C3)[N+](=O)[O-]
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Product OPENEYE NAME: N-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]-3-nitro-4-(2-phenylethyl)-1H-pyrrol-2-amine
CAS Name: N-[2-[(5-methyl-1H-imidazol-4-yl)methylthio]ethyl]-3-nitro-4-(2-phenylethyl)-1H-pyrrol-2-amine
IUPAC NAME: N-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]-3-nitro-4-(2-phenylethyl)-1H-pyrrol-2-amine
SYSTEMATIC NAME: N-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]-3-nitro-4-(2-phenylethyl)-1H-pyrrol-2-amine
MOLECULAR FORMULA: C19H23N5O2S
MOLECULAR WEIGHT: 385.48322
SMILES: CC1=C(N=CN1)CSCCNC2=C(C(=CN2)CCC3=CC=CC=C3)[N+](=O)[O-]
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Product OPENEYE NAME: 4-butyl-N-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]-3-nitro-1H-pyrrol-2-amine
CAS Name: 4-butyl-N-[2-[(5-methyl-1H-imidazol-4-yl)methylthio]ethyl]-3-nitro-1H-pyrrol-2-amine
IUPAC NAME: 4-butyl-N-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]-3-nitro-1H-pyrrol-2-amine
SYSTEMATIC NAME: 4-butyl-N-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]-3-nitro-1H-pyrrol-2-amine
MOLECULAR FORMULA: C15H23N5O2S
MOLECULAR WEIGHT: 337.44042
SMILES: CCCCC1=CNC(=C1[N+](=O)[O-])NCCSCC2=C(NC=N2)C
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Product OPENEYE NAME: 4-methyl-2-methylsulfanyl-3-nitro-1H-pyrrole
CAS Name: 4-methyl-2-(methylthio)-3-nitro-1H-pyrrole
IUPAC NAME: 4-methyl-2-methylsulfanyl-3-nitro-1H-pyrrole
SYSTEMATIC NAME: 4-methyl-2-methylsulfanyl-3-nitro-1H-pyrrole
MOLECULAR FORMULA: C6H8N2O2S
MOLECULAR WEIGHT: 172.20492
SMILES: CC1=CNC(=C1[N+](=O)[O-])SC
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Product OPENEYE NAME: 4-methyl-2-methylsulfinyl-3-nitro-1H-pyrrole
CAS Name: 4-methyl-2-methylsulfinyl-3-nitro-1H-pyrrole
IUPAC NAME: 4-methyl-2-methylsulfinyl-3-nitro-1H-pyrrole
SYSTEMATIC NAME: 4-methyl-2-methylsulfinyl-3-nitro-1H-pyrrole
MOLECULAR FORMULA: C6H8N2O3S
MOLECULAR WEIGHT: 188.20432
SMILES: CC1=CNC(=C1[N+](=O)[O-])S(=O)C
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Product OPENEYE NAME: 4-benzyl-2-methylsulfanyl-3-nitro-1H-pyrrole
CAS Name: 2-(methylthio)-3-nitro-4-(phenylmethyl)-1H-pyrrole
IUPAC NAME: 4-benzyl-2-methylsulfanyl-3-nitro-1H-pyrrole
SYSTEMATIC NAME: 2-methylsulfanyl-3-nitro-4-(phenylmethyl)-1H-pyrrole
MOLECULAR FORMULA: C12H12N2O2S
MOLECULAR WEIGHT: 248.30088
SMILES: CSC1=C(C(=CN1)CC2=CC=CC=C2)[N+](=O)[O-]
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Product OPENEYE NAME: 4-benzyl-2-methylsulfinyl-3-nitro-1H-pyrrole
CAS Name: 2-methylsulfinyl-3-nitro-4-(phenylmethyl)-1H-pyrrole
IUPAC NAME: 4-benzyl-2-methylsulfinyl-3-nitro-1H-pyrrole
SYSTEMATIC NAME: 2-methylsulfinyl-3-nitro-4-(phenylmethyl)-1H-pyrrole
MOLECULAR FORMULA: C12H12N2O3S
MOLECULAR WEIGHT: 264.30028
SMILES: CS(=O)C1=C(C(=CN1)CC2=CC=CC=C2)[N+](=O)[O-]
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Product OPENEYE NAME: 2-methylsulfanyl-3-nitro-4-phenyl-1H-pyrrole
CAS Name: 2-(methylthio)-3-nitro-4-phenyl-1H-pyrrole
IUPAC NAME: 2-methylsulfanyl-3-nitro-4-phenyl-1H-pyrrole
SYSTEMATIC NAME: 2-methylsulfanyl-3-nitro-4-phenyl-1H-pyrrole
MOLECULAR FORMULA: C11H10N2O2S
MOLECULAR WEIGHT: 234.2743
SMILES: CSC1=C(C(=CN1)C2=CC=CC=C2)[N+](=O)[O-]
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Product OPENEYE NAME: 2-methylsulfinyl-3-nitro-4-phenyl-1H-pyrrole
CAS Name: 2-methylsulfinyl-3-nitro-4-phenyl-1H-pyrrole
IUPAC NAME: 2-methylsulfinyl-3-nitro-4-phenyl-1H-pyrrole
SYSTEMATIC NAME: 2-methylsulfinyl-3-nitro-4-phenyl-1H-pyrrole
MOLECULAR FORMULA: C11H10N2O3S
MOLECULAR WEIGHT: 250.2737
SMILES: CS(=O)C1=C(C(=CN1)C2=CC=CC=C2)[N+](=O)[O-]
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Product OPENEYE NAME: 2-methylsulfanyl-3-nitro-4-(2-phenylethyl)-1H-pyrrole
CAS Name: 2-(methylthio)-3-nitro-4-(2-phenylethyl)-1H-pyrrole
IUPAC NAME: 2-methylsulfanyl-3-nitro-4-(2-phenylethyl)-1H-pyrrole
SYSTEMATIC NAME: 2-methylsulfanyl-3-nitro-4-(2-phenylethyl)-1H-pyrrole
MOLECULAR FORMULA: C13H14N2O2S
MOLECULAR WEIGHT: 262.32746
SMILES: CSC1=C(C(=CN1)CCC2=CC=CC=C2)[N+](=O)[O-]
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