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MOLECULAR FORMULA: C17H16ClN5O
MOLECULAR WEIGHT: 341.79484
SMILES: CC1=NN(C2=NC=C3C(=C12)N(N(C3=O)CC4=CC=CC=C4Cl)C)C
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Product OPENEYE NAME: 1-[5-(3-cyclohexylprop-1-ynyl)-2-thienyl]-3-(dimethylamino)prop-2-en-1-one
CAS Name: 1-[5-(3-cyclohexylprop-1-ynyl)-2-thiophenyl]-3-(dimethylamino)-2-propen-1-one
IUPAC NAME: 1-[5-(3-cyclohexylprop-1-ynyl)thiophen-2-yl]-3-(dimethylamino)prop-2-en-1-one
SYSTEMATIC NAME: 1-[5-(3-cyclohexylprop-1-ynyl)thiophen-2-yl]-3-(dimethylamino)prop-2-en-1-one
MOLECULAR FORMULA: C18H23NOS
MOLECULAR WEIGHT: 301.44632
SMILES: CN(C)C=CC(=O)C1=CC=C(S1)C#CCC2CCCCC2
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MOLECULAR FORMULA: C17H16ClN5O
MOLECULAR WEIGHT: 341.79484
SMILES: CC1=NN(C2=NC=C3C(=C12)N(N(C3=O)CC4=CC=C(C=C4)Cl)C)C
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MOLECULAR FORMULA: C19H21N5O
MOLECULAR WEIGHT: 335.40294
SMILES: CC1=CC(=C(C=C1)C)CN2C(=O)C3=CN=C4C(=C3N2C)C(=NN4C)C
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MOLECULAR FORMULA: C17H17N5O
MOLECULAR WEIGHT: 307.34978
SMILES: CC1=NN(C2=NC=C3C(=C12)N(N(C3=O)CC4=CC=CC=C4)C)C
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Product OPENEYE NAME: 1-[[2-(1-benzhydrylazetidin-3-yl)sulfanylacetyl]amino]-3-phenyl-urea
CAS Name: 1-[[2-[[1-(diphenylmethyl)-3-azetidinyl]thio]-1-oxoethyl]amino]-3-phenylurea
IUPAC NAME: 1-[[2-(1-benzhydrylazetidin-3-yl)sulfanylacetyl]amino]-3-phenylurea
SYSTEMATIC NAME: 1-[2-[1-(diphenylmethyl)azetidin-3-yl]sulfanylethanoylamino]-3-phenyl-urea
MOLECULAR FORMULA: C25H26N4O2S
MOLECULAR WEIGHT: 446.56454
SMILES: C1C(CN1C(C2=CC=CC=C2)C3=CC=CC=C3)SCC(=O)NNC(=O)NC4=CC=CC=C4
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Product OPENEYE NAME: 1-[[2-(1-benzhydrylazetidin-3-yl)sulfanylacetyl]amino]-3-(3,5-dichlorophenyl)urea
CAS Name: 1-(3,5-dichlorophenyl)-3-[[2-[[1-(diphenylmethyl)-3-azetidinyl]thio]-1-oxoethyl]amino]urea
IUPAC NAME: 1-[[2-(1-benzhydrylazetidin-3-yl)sulfanylacetyl]amino]-3-(3,5-dichlorophenyl)urea
SYSTEMATIC NAME: 1-[3,5-bis(chloranyl)phenyl]-3-[2-[1-(diphenylmethyl)azetidin-3-yl]sulfanylethanoylamino]urea
MOLECULAR FORMULA: C25H24Cl2N4O2S
MOLECULAR WEIGHT: 515.45466
SMILES: C1C(CN1C(C2=CC=CC=C2)C3=CC=CC=C3)SCC(=O)NNC(=O)NC4=CC(=CC(=C4)Cl)Cl
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Product OPENEYE NAME: 4-[4-(benzenesulfonyl)piperazin-1-yl]-2-(trifluoromethyl)quinoline
CAS Name: 4-[4-(benzenesulfonyl)-1-piperazinyl]-2-(trifluoromethyl)quinoline
IUPAC NAME: 4-[4-(benzenesulfonyl)piperazin-1-yl]-2-(trifluoromethyl)quinoline
SYSTEMATIC NAME: 4-[4-(phenylsulfonyl)piperazin-1-yl]-2-(trifluoromethyl)quinoline
MOLECULAR FORMULA: C20H18F3N3O2S
MOLECULAR WEIGHT: 421.43603
SMILES: C1CN(CCN1C2=CC(=NC3=CC=CC=C32)C(F)(F)F)S(=O)(=O)C4=CC=CC=C4
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Product OPENEYE NAME: 4-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-2-(trifluoromethyl)quinoline
CAS Name: 4-[4-(4-methoxyphenyl)sulfonyl-1-piperazinyl]-2-(trifluoromethyl)quinoline
IUPAC NAME: 4-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-2-(trifluoromethyl)quinoline
SYSTEMATIC NAME: 4-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-2-(trifluoromethyl)quinoline
MOLECULAR FORMULA: C21H20F3N3O3S
MOLECULAR WEIGHT: 451.46201
SMILES: COC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=CC(=NC4=CC=CC=C43)C(F)(F)F
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Product OPENEYE NAME: (4-chlorophenyl)-[4-[2-(trifluoromethyl)-4-quinolyl]piperazin-1-yl]methanone
CAS Name: (4-chlorophenyl)-[4-[2-(trifluoromethyl)-4-quinolinyl]-1-piperazinyl]methanone
IUPAC NAME: (4-chlorophenyl)-[4-[2-(trifluoromethyl)quinolin-4-yl]piperazin-1-yl]methanone
SYSTEMATIC NAME: (4-chlorophenyl)-[4-[2-(trifluoromethyl)quinolin-4-yl]piperazin-1-yl]methanone
MOLECULAR FORMULA: C21H17ClF3N3O
MOLECULAR WEIGHT: 419.82739
SMILES: C1CN(CCN1C2=CC(=NC3=CC=CC=C32)C(F)(F)F)C(=O)C4=CC=C(C=C4)Cl
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Product OPENEYE NAME: phenyl-[4-[2-(trifluoromethyl)-4-quinolyl]piperazin-1-yl]methanone
CAS Name: phenyl-[4-[2-(trifluoromethyl)-4-quinolinyl]-1-piperazinyl]methanone
IUPAC NAME: phenyl-[4-[2-(trifluoromethyl)quinolin-4-yl]piperazin-1-yl]methanone
SYSTEMATIC NAME: phenyl-[4-[2-(trifluoromethyl)quinolin-4-yl]piperazin-1-yl]methanone
MOLECULAR FORMULA: C21H18F3N3O
MOLECULAR WEIGHT: 385.38233
SMILES: C1CN(CCN1C2=CC(=NC3=CC=CC=C32)C(F)(F)F)C(=O)C4=CC=CC=C4
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Product OPENEYE NAME: 2-thienyl-[4-[2-(trifluoromethyl)-4-quinolyl]piperazin-1-yl]methanone
CAS Name: thiophen-2-yl-[4-[2-(trifluoromethyl)-4-quinolinyl]-1-piperazinyl]methanone
IUPAC NAME: thiophen-2-yl-[4-[2-(trifluoromethyl)quinolin-4-yl]piperazin-1-yl]methanone
SYSTEMATIC NAME: thiophen-2-yl-[4-[2-(trifluoromethyl)quinolin-4-yl]piperazin-1-yl]methanone
MOLECULAR FORMULA: C19H16F3N3OS
MOLECULAR WEIGHT: 391.41005
SMILES: C1CN(CCN1C2=CC(=NC3=CC=CC=C32)C(F)(F)F)C(=O)C4=CC=CS4
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Product OPENEYE NAME: 2-(trifluoromethyl)-4-[4-[5-(trifluoromethyl)-2-pyridyl]piperazin-1-yl]quinoline
CAS Name: 2-(trifluoromethyl)-4-[4-[5-(trifluoromethyl)-2-pyridinyl]-1-piperazinyl]quinoline
IUPAC NAME: 2-(trifluoromethyl)-4-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]quinoline
SYSTEMATIC NAME: 2-(trifluoromethyl)-4-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]quinoline
MOLECULAR FORMULA: C20H16F6N4
MOLECULAR WEIGHT: 426.358259
SMILES: C1CN(CCN1C2=NC=C(C=C2)C(F)(F)F)C3=CC(=NC4=CC=CC=C43)C(F)(F)F
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Product OPENEYE NAME: 4-[4-[5-chloro-3-(trifluoromethyl)-2-pyridyl]piperazin-1-yl]-2-(trifluoromethyl)quinoline
CAS Name: 4-[4-[5-chloro-3-(trifluoromethyl)-2-pyridinyl]-1-piperazinyl]-2-(trifluoromethyl)quinoline
IUPAC NAME: 4-[4-[5-chloro-3-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]-2-(trifluoromethyl)quinoline
SYSTEMATIC NAME: 4-[4-[5-chloranyl-3-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]-2-(trifluoromethyl)quinoline
MOLECULAR FORMULA: C20H15ClF6N4
MOLECULAR WEIGHT: 460.803319
SMILES: C1CN(CCN1C2=CC(=NC3=CC=CC=C32)C(F)(F)F)C4=NC=C(C=C4C(F)(F)F)Cl
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Product OPENEYE NAME: 2-(trifluoromethyl)-4-[4-[6-(trifluoromethyl)-2-pyridyl]piperazin-1-yl]quinoline
CAS Name: 2-(trifluoromethyl)-4-[4-[6-(trifluoromethyl)-2-pyridinyl]-1-piperazinyl]quinoline
IUPAC NAME: 2-(trifluoromethyl)-4-[4-[6-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]quinoline
SYSTEMATIC NAME: 2-(trifluoromethyl)-4-[4-[6-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]quinoline
MOLECULAR FORMULA: C20H16F6N4
MOLECULAR WEIGHT: 426.358259
SMILES: C1CN(CCN1C2=CC=CC(=N2)C(F)(F)F)C3=CC(=NC4=CC=CC=C43)C(F)(F)F
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Product OPENEYE NAME: 4-[4-[3-chloro-5-(trifluoromethyl)-2-pyridyl]piperazin-1-yl]-2-(trifluoromethyl)quinoline
CAS Name: 4-[4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1-piperazinyl]-2-(trifluoromethyl)quinoline
IUPAC NAME: 4-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]-2-(trifluoromethyl)quinoline
SYSTEMATIC NAME: 4-[4-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]-2-(trifluoromethyl)quinoline
MOLECULAR FORMULA: C20H15ClF6N4
MOLECULAR WEIGHT: 460.803319
SMILES: C1CN(CCN1C2=CC(=NC3=CC=CC=C32)C(F)(F)F)C4=C(C=C(C=N4)C(F)(F)F)Cl
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Product OPENEYE NAME: 4-nitro-5-[[5-(trifluoromethyl)-2-pyridyl]sulfanyl]thiophene-2-sulfonamide
CAS Name: 4-nitro-5-[[5-(trifluoromethyl)-2-pyridinyl]thio]-2-thiophenesulfonamide
IUPAC NAME: 4-nitro-5-[5-(trifluoromethyl)pyridin-2-yl]sulfanylthiophene-2-sulfonamide
SYSTEMATIC NAME: 4-nitro-5-[5-(trifluoromethyl)pyridin-2-yl]sulfanyl-thiophene-2-sulfonamide
MOLECULAR FORMULA: C10H6F3N3O4S3
MOLECULAR WEIGHT: 385.36255
SMILES: C1=CC(=NC=C1C(F)(F)F)SC2=C(C=C(S2)S(=O)(=O)N)[N+](=O)[O-]
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Product OPENEYE NAME: 5-(1-methylimidazol-2-yl)sulfanyl-4-nitro-thiophene-2-sulfonamide
CAS Name: 5-[(1-methyl-2-imidazolyl)thio]-4-nitro-2-thiophenesulfonamide
IUPAC NAME: 5-(1-methylimidazol-2-yl)sulfanyl-4-nitrothiophene-2-sulfonamide
SYSTEMATIC NAME: 5-(1-methylimidazol-2-yl)sulfanyl-4-nitro-thiophene-2-sulfonamide
MOLECULAR FORMULA: C8H8N4O4S3
MOLECULAR WEIGHT: 320.36852
SMILES: CN1C=CN=C1SC2=C(C=C(S2)S(=O)(=O)N)[N+](=O)[O-]
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Product OPENEYE NAME: 3-(4-pyridyl)-5-(trifluoromethyl)-1,4-dihydropyrazol-5-ol
CAS Name: 3-pyridin-4-yl-5-(trifluoromethyl)-1,4-dihydropyrazol-5-ol
IUPAC NAME: 3-pyridin-4-yl-5-(trifluoromethyl)-1,4-dihydropyrazol-5-ol
SYSTEMATIC NAME: 3-pyridin-4-yl-5-(trifluoromethyl)-1,4-dihydropyrazol-5-ol
MOLECULAR FORMULA: C9H8F3N3O
MOLECULAR WEIGHT: 231.17453
SMILES: C1C(=NNC1(C(F)(F)F)O)C2=CC=NC=C2
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Product OPENEYE NAME: 4-nitro-5-(1-piperidyl)thiophene-2-sulfonamide
CAS Name: 4-nitro-5-(1-piperidinyl)-2-thiophenesulfonamide
IUPAC NAME: 4-nitro-5-piperidin-1-ylthiophene-2-sulfonamide
SYSTEMATIC NAME: 4-nitro-5-piperidin-1-yl-thiophene-2-sulfonamide
MOLECULAR FORMULA: C9H13N3O4S2
MOLECULAR WEIGHT: 291.34722
SMILES: C1CCN(CC1)C2=C(C=C(S2)S(=O)(=O)N)[N+](=O)[O-]
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Product OPENEYE NAME: 4-nitro-5-pyrrolidin-1-yl-thiophene-2-sulfonamide
CAS Name: 4-nitro-5-(1-pyrrolidinyl)-2-thiophenesulfonamide
IUPAC NAME: 4-nitro-5-pyrrolidin-1-ylthiophene-2-sulfonamide
SYSTEMATIC NAME: 4-nitro-5-pyrrolidin-1-yl-thiophene-2-sulfonamide
MOLECULAR FORMULA: C8H11N3O4S2
MOLECULAR WEIGHT: 277.32064
SMILES: C1CCN(C1)C2=C(C=C(S2)S(=O)(=O)N)[N+](=O)[O-]
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Product OPENEYE NAME: 5-morpholino-4-nitro-thiophene-2-sulfonamide
CAS Name: 5-(4-morpholinyl)-4-nitro-2-thiophenesulfonamide
IUPAC NAME: 5-morpholin-4-yl-4-nitrothiophene-2-sulfonamide
SYSTEMATIC NAME: 5-morpholin-4-yl-4-nitro-thiophene-2-sulfonamide
MOLECULAR FORMULA: C8H11N3O5S2
MOLECULAR WEIGHT: 293.32004
SMILES: C1COCCN1C2=C(C=C(S2)S(=O)(=O)N)[N+](=O)[O-]
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