Product OPENEYE NAME: 2-[(2Z)-5-chloro-2-[[5-methoxy-3-(2-sulfoethyl)-1,3-benzothiazol-3-ium-2-yl]methylene]-1,3-benzothiazol-3-yl]ethanesulfonic acid
CAS Name: 2-[(2Z)-5-chloro-2-[[5-methoxy-3-(2-sulfoethyl)-1,3-benzothiazol-3-ium-2-yl]methylidene]-1,3-benzothiazol-3-yl]ethanesulfonic acid
IUPAC NAME: 2-[(2Z)-5-chloro-2-[[5-methoxy-3-(2-sulfoethyl)-1,3-benzothiazol-3-ium-2-yl]methylidene]-1,3-benzothiazol-3-yl]ethanesulfonic acid
SYSTEMATIC NAME: 2-[(2Z)-5-chloranyl-2-[[5-methoxy-3-(2-sulfoethyl)-1,3-benzothiazol-3-ium-2-yl]methylidene]-1,3-benzothiazol-3-yl]ethanesulfonic acid
MOLECULAR FORMULA: C20H20ClN2O7S4+
MOLECULAR WEIGHT: 564.095
SMILES: COC1=CC2=C(C=C1)SC(=[N+]2CCS(=O)(=O)O)/C=C\3/N(C4=C(S3)C=CC(=C4)Cl)CCS(=O)(=O)O
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Product OPENEYE NAME: N-[2-chloro-5-(hexadecylsulfonylamino)phenyl]-2-[4-(4-hydroxyphenyl)sulfonylphenyl]-4,4-dimethyl-3-oxo-pentanamide
CAS Name: N-[2-chloro-5-(hexadecylsulfonylamino)phenyl]-2-[4-(4-hydroxyphenyl)sulfonylphenyl]-4,4-dimethyl-3-oxopentanamide
IUPAC NAME: N-[2-chloro-5-(hexadecylsulfonylamino)phenyl]-2-[4-(4-hydroxyphenyl)sulfonylphenyl]-4,4-dimethyl-3-oxopentanamide
SYSTEMATIC NAME: N-[2-chloranyl-5-(hexadecylsulfonylamino)phenyl]-2-[4-(4-hydroxyphenyl)sulfonylphenyl]-4,4-dimethyl-3-oxidanylidene-pentanamide
MOLECULAR FORMULA: C41H57ClN2O7S2
MOLECULAR WEIGHT: 789.48348
SMILES: CCCCCCCCCCCCCCCCS(=O)(=O)NC1=CC(=C(C=C1)Cl)NC(=O)C(C2=CC=C(C=C2)S(=O)(=O)C3=CC=C(C=C3)O)C(=O)C(C)(C)C
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Product OPENEYE NAME: 3-[4-(3-ethyl-5-oxo-1-phenyl-2-thioxo-imidazolidin-4-ylidene)-1-pyridyl]propanoic acid
CAS Name: 3-[4-(3-ethyl-5-oxo-1-phenyl-2-sulfanylidene-4-imidazolidinylidene)-1-pyridinyl]propanoic acid
IUPAC NAME: 3-[4-(3-ethyl-5-oxo-1-phenyl-2-sulfanylideneimidazolidin-4-ylidene)pyridin-1-yl]propanoic acid
SYSTEMATIC NAME: 3-[4-(3-ethyl-5-oxidanylidene-1-phenyl-2-sulfanylidene-imidazolidin-4-ylidene)pyridin-1-yl]propanoic acid
MOLECULAR FORMULA: C19H19N3O3S
MOLECULAR WEIGHT: 369.43746
SMILES: CCN1C(=C2C=CN(C=C2)CCC(=O)O)C(=O)N(C1=S)C3=CC=CC=C3
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Product OPENEYE NAME: 2-decyl-3,6-dihydroxy-benzenesulfonate
CAS Name: 2-decyl-3,6-dihydroxybenzenesulfonate
IUPAC NAME: 2-decyl-3,6-dihydroxybenzenesulfonate
SYSTEMATIC NAME: 2-decyl-3,6-bis(oxidanyl)benzenesulfonate
MOLECULAR FORMULA: C16H25O5S-
MOLECULAR WEIGHT: 329.4317
SMILES: CCCCCCCCCCC1=C(C=CC(=C1S(=O)(=O)[O-])O)O
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Product OPENEYE NAME: 2-decyl-3,6-dihydroxy-benzenesulfonic acid
CAS Name: 2-decyl-3,6-dihydroxybenzenesulfonic acid
IUPAC NAME: 2-decyl-3,6-dihydroxybenzenesulfonic acid
SYSTEMATIC NAME: 2-decyl-3,6-bis(oxidanyl)benzenesulfonic acid
MOLECULAR FORMULA: C16H26O5S
MOLECULAR WEIGHT: 330.43964
SMILES: CCCCCCCCCCC1=C(C=CC(=C1S(=O)(=O)O)O)O
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Product OPENEYE NAME: N-hexyl-N-[(E)-prop-1-enyl]hexan-1-amine
CAS Name: N-hexyl-N-[(E)-prop-1-enyl]-1-hexanamine
IUPAC NAME: N-hexyl-N-[(E)-prop-1-enyl]hexan-1-amine
SYSTEMATIC NAME: N-hexyl-N-[(E)-prop-1-enyl]hexan-1-amine
MOLECULAR FORMULA: C15H31N
MOLECULAR WEIGHT: 225.41334
SMILES: CCCCCCN(CCCCCC)/C=C/C
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Product OPENEYE NAME: (1E,3E)-4-(5,6-dichloro-1,3-diethyl-2H-benzimidazol-2-yl)-N,N-diethyl-buta-1,3-dien-1-amine iodide
CAS Name: (1E,3E)-4-(5,6-dichloro-1,3-diethyl-2H-benzimidazol-2-yl)-N,N-diethyl-1-buta-1,3-dienamine iodide
IUPAC NAME: (1E,3E)-4-(5,6-dichloro-1,3-diethyl-2H-benzimidazol-2-yl)-N,N-diethylbuta-1,3-dien-1-amine iodide
SYSTEMATIC NAME: (1E,3E)-4-[5,6-bis(chloranyl)-1,3-diethyl-2H-benzimidazol-2-yl]-N,N-diethyl-buta-1,3-dien-1-amine iodide
MOLECULAR FORMULA: C19H27Cl2IN3-
MOLECULAR WEIGHT: 495.24825
SMILES: CCN1C(N(C2=CC(=C(C=C21)Cl)Cl)CC)/C=C/C=C/N(CC)CC.[I-]
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Product OPENEYE NAME: (1E,3E)-4-(5,6-dichloro-1,3-diethyl-2H-benzimidazol-2-yl)-N,N-diethyl-buta-1,3-dien-1-amine
CAS Name: (1E,3E)-4-(5,6-dichloro-1,3-diethyl-2H-benzimidazol-2-yl)-N,N-diethyl-1-buta-1,3-dienamine
IUPAC NAME: (1E,3E)-4-(5,6-dichloro-1,3-diethyl-2H-benzimidazol-2-yl)-N,N-diethylbuta-1,3-dien-1-amine
SYSTEMATIC NAME: (1E,3E)-4-[5,6-bis(chloranyl)-1,3-diethyl-2H-benzimidazol-2-yl]-N,N-diethyl-buta-1,3-dien-1-amine
MOLECULAR FORMULA: C19H27Cl2N3
MOLECULAR WEIGHT: 368.34378
SMILES: CCN1C(N(C2=CC(=C(C=C21)Cl)Cl)CC)/C=C/C=C/N(CC)CC
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Product OPENEYE NAME: (1E)-1-(3-ethyl-1,3-benzothiazol-2-ylidene)-2-methyl-3,4-dihydro-2H-pyrido[2,1-b][1,3]benzothiazol-10-ium iodide
CAS Name: (1E)-1-(3-ethyl-1,3-benzothiazol-2-ylidene)-2-methyl-3,4-dihydro-2H-pyrido[2,1-b][1,3]benzothiazol-10-ium iodide
IUPAC NAME: (1E)-1-(3-ethyl-1,3-benzothiazol-2-ylidene)-2-methyl-3,4-dihydro-2H-pyrido[2,1-b][1,3]benzothiazol-10-ium iodide
SYSTEMATIC NAME: (1E)-1-(3-ethyl-1,3-benzothiazol-2-ylidene)-2-methyl-3,4-dihydro-2H-pyrido[2,1-b][1,3]benzothiazol-10-ium iodide
MOLECULAR FORMULA: C21H21IN2S2
MOLECULAR WEIGHT: 492.43931
SMILES: CCN\1C2=CC=CC=C2S/C1=C/3\C(CCC4=[N+]3C5=CC=CC=C5S4)C.[I-]
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Product OPENEYE NAME: (1E)-1-(3-ethyl-1,3-benzothiazol-2-ylidene)-2-methyl-3,4-dihydro-2H-pyrido[2,1-b][1,3]benzothiazol-10-ium
CAS Name: (1E)-1-(3-ethyl-1,3-benzothiazol-2-ylidene)-2-methyl-3,4-dihydro-2H-pyrido[2,1-b][1,3]benzothiazol-10-ium
IUPAC NAME: (1E)-1-(3-ethyl-1,3-benzothiazol-2-ylidene)-2-methyl-3,4-dihydro-2H-pyrido[2,1-b][1,3]benzothiazol-10-ium
SYSTEMATIC NAME: (1E)-1-(3-ethyl-1,3-benzothiazol-2-ylidene)-2-methyl-3,4-dihydro-2H-pyrido[2,1-b][1,3]benzothiazol-10-ium
MOLECULAR FORMULA: C21H21N2S2+
MOLECULAR WEIGHT: 365.53484
SMILES: CCN\1C2=CC=CC=C2S/C1=C/3\C(CCC4=[N+]3C5=CC=CC=C5S4)C
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Product OPENEYE NAME: 5-[(E)-3-anilinoprop-2-enylidene]-1,3-diethyl-2-thioxo-hexahydropyrimidine-4,6-dione
CAS Name: 5-[(E)-3-anilinoprop-2-enylidene]-1,3-diethyl-2-sulfanylidene-1,3-diazinane-4,6-dione
IUPAC NAME: 5-[(E)-3-anilinoprop-2-enylidene]-1,3-diethyl-2-sulfanylidene-1,3-diazinane-4,6-dione
SYSTEMATIC NAME: 1,3-diethyl-5-[(E)-3-phenylazanylprop-2-enylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
MOLECULAR FORMULA: C17H19N3O2S
MOLECULAR WEIGHT: 329.41666
SMILES: CCN1C(=O)C(=C/C=C/NC2=CC=CC=C2)C(=O)N(C1=S)CC
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Product OPENEYE NAME: butyl 2-(N-acetylanilino)acetate
CAS Name: 2-(N-acetylanilino)acetic acid butyl ester
IUPAC NAME: butyl 2-(N-acetylanilino)acetate
SYSTEMATIC NAME: butyl 2-[ethanoyl(phenyl)amino]ethanoate
MOLECULAR FORMULA: C14H19NO3
MOLECULAR WEIGHT: 249.30556
SMILES: CCCCOC(=O)CN(C1=CC=CC=C1)C(=O)C
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Product OPENEYE NAME: methyl 2-(N-(2,4-diamino-4-oxo-butanoyl)anilino)acetate
CAS Name: 2-(N-(2,4-diamino-1,4-dioxobutyl)anilino)acetic acid methyl ester
IUPAC NAME: methyl 2-(N-(2,4-diamino-4-oxobutanoyl)anilino)acetate
SYSTEMATIC NAME: methyl 2-[[2,4-bis(azanyl)-4-oxidanylidene-butanoyl]-phenyl-amino]ethanoate
MOLECULAR FORMULA: C13H17N3O4
MOLECULAR WEIGHT: 279.29178
SMILES: COC(=O)CN(C1=CC=CC=C1)C(=O)C(CC(=O)N)N
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