Product OPENEYE NAME: 5-bromo-N4-cyclobutyl-N2-(1H-indazol-6-yl)-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine
CAS Name: 5-bromo-N4-cyclobutyl-N2-(1H-indazol-6-yl)-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine
IUPAC NAME: 5-bromo-4-N-cyclobutyl-2-N-(1H-indazol-6-yl)-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine
SYSTEMATIC NAME: 5-bromanyl-N4-cyclobutyl-N2-(1H-indazol-6-yl)-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine
MOLECULAR FORMULA: C17H16BrN7
MOLECULAR WEIGHT: 398.25984
SMILES: C1CC(C1)NC2=NC(=NC3=C2C(=CN3)Br)NC4=CC5=C(C=C4)C=NN5
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Product OPENEYE NAME: N-[6-[[7-methoxy-6-[3-(4-methylpiperazin-1-yl)propoxy]quinazolin-4-yl]amino]-1,3-benzothiazol-2-yl]benzamide
CAS Name: N-[6-[[7-methoxy-6-[3-(4-methyl-1-piperazinyl)propoxy]-4-quinazolinyl]amino]-1,3-benzothiazol-2-yl]benzamide
IUPAC NAME: N-[6-[[7-methoxy-6-[3-(4-methylpiperazin-1-yl)propoxy]quinazolin-4-yl]amino]-1,3-benzothiazol-2-yl]benzamide
SYSTEMATIC NAME: N-[6-[[7-methoxy-6-[3-(4-methylpiperazin-1-yl)propoxy]quinazolin-4-yl]amino]-1,3-benzothiazol-2-yl]benzamide
MOLECULAR FORMULA: C31H33N7O3S
MOLECULAR WEIGHT: 583.70382
SMILES: CN1CCN(CC1)CCCOC2=C(C=C3C(=C2)C(=NC=N3)NC4=CC5=C(C=C4)N=C(S5)NC(=O)C6=CC=CC=C6)OC
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Product OPENEYE NAME: N-[6-[[6-methoxy-7-[3-(4-methylpiperazin-1-yl)propoxy]quinazolin-4-yl]amino]-1,3-benzoxazol-2-yl]benzamide
CAS Name: N-[6-[[6-methoxy-7-[3-(4-methyl-1-piperazinyl)propoxy]-4-quinazolinyl]amino]-1,3-benzoxazol-2-yl]benzamide
IUPAC NAME: N-[6-[[6-methoxy-7-[3-(4-methylpiperazin-1-yl)propoxy]quinazolin-4-yl]amino]-1,3-benzoxazol-2-yl]benzamide
SYSTEMATIC NAME: N-[6-[[6-methoxy-7-[3-(4-methylpiperazin-1-yl)propoxy]quinazolin-4-yl]amino]-1,3-benzoxazol-2-yl]benzamide
MOLECULAR FORMULA: C31H33N7O4
MOLECULAR WEIGHT: 567.63822
SMILES: CN1CCN(CC1)CCCOC2=C(C=C3C(=C2)N=CN=C3NC4=CC5=C(C=C4)N=C(O5)NC(=O)C6=CC=CC=C6)OC
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Product OPENEYE NAME: N-[5-[[6-methoxy-7-[3-(4-methylpiperazin-1-yl)propoxy]quinazolin-4-yl]amino]-1,3-benzothiazol-2-yl]benzamide
CAS Name: N-[5-[[6-methoxy-7-[3-(4-methyl-1-piperazinyl)propoxy]-4-quinazolinyl]amino]-1,3-benzothiazol-2-yl]benzamide
IUPAC NAME: N-[5-[[6-methoxy-7-[3-(4-methylpiperazin-1-yl)propoxy]quinazolin-4-yl]amino]-1,3-benzothiazol-2-yl]benzamide
SYSTEMATIC NAME: N-[5-[[6-methoxy-7-[3-(4-methylpiperazin-1-yl)propoxy]quinazolin-4-yl]amino]-1,3-benzothiazol-2-yl]benzamide
MOLECULAR FORMULA: C31H33N7O3S
MOLECULAR WEIGHT: 583.70382
SMILES: CN1CCN(CC1)CCCOC2=C(C=C3C(=C2)N=CN=C3NC4=CC5=C(C=C4)SC(=N5)NC(=O)C6=CC=CC=C6)OC
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Product OPENEYE NAME: 6-[[5-chloro-4-(2-isopropylsulfonylanilino)pyrimidin-2-yl]amino]-5-isopropoxy-2-[1-(1-methylpyrrolidine-2-carbonyl)-4-piperidyl]isoindolin-1-one
CAS Name: 6-[[5-chloro-4-(2-propan-2-ylsulfonylanilino)-2-pyrimidinyl]amino]-2-[1-[(1-methyl-2-pyrrolidinyl)-oxomethyl]-4-piperidinyl]-5-propan-2-yloxy-3H-isoindol-1-one
IUPAC NAME: 6-[[5-chloro-4-(2-propan-2-ylsulfonylanilino)pyrimidin-2-yl]amino]-2-[1-(1-methylpyrrolidine-2-carbonyl)piperidin-4-yl]-5-propan-2-yloxy-3H-isoindol-1-one
SYSTEMATIC NAME: 6-[[5-chloranyl-4-[(2-propan-2-ylsulfonylphenyl)amino]pyrimidin-2-yl]amino]-2-[1-(1-methylpyrrolidin-2-yl)carbonylpiperidin-4-yl]-5-propan-2-yloxy-3H-isoindol-1-one
MOLECULAR FORMULA: C35H44ClN7O5S
MOLECULAR WEIGHT: 710.28576
SMILES: CC(C)OC1=C(C=C2C(=C1)CN(C2=O)C3CCN(CC3)C(=O)C4CCCN4C)NC5=NC=C(C(=N5)NC6=CC=CC=C6S(=O)(=O)C(C)C)Cl
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Product OPENEYE NAME: 6-[[5-chloro-4-(2-isopropylsulfonylanilino)pyrimidin-2-yl]amino]-5-isopropoxy-2-[1-[(2S)-1-methylpyrrolidine-2-carbonyl]-4-piperidyl]isoindolin-1-one
CAS Name: 6-[[5-chloro-4-(2-propan-2-ylsulfonylanilino)-2-pyrimidinyl]amino]-2-[1-[[(2S)-1-methyl-2-pyrrolidinyl]-oxomethyl]-4-piperidinyl]-5-propan-2-yloxy-3H-isoindol-1-one
IUPAC NAME: 6-[[5-chloro-4-(2-propan-2-ylsulfonylanilino)pyrimidin-2-yl]amino]-2-[1-[(2S)-1-methylpyrrolidine-2-carbonyl]piperidin-4-yl]-5-propan-2-yloxy-3H-isoindol-1-one
SYSTEMATIC NAME: 6-[[5-chloranyl-4-[(2-propan-2-ylsulfonylphenyl)amino]pyrimidin-2-yl]amino]-2-[1-[(2S)-1-methylpyrrolidin-2-yl]carbonylpiperidin-4-yl]-5-propan-2-yloxy-3H-isoindol-1-one
MOLECULAR FORMULA: C35H44ClN7O5S
MOLECULAR WEIGHT: 710.28576
SMILES: CC(C)OC1=C(C=C2C(=C1)CN(C2=O)C3CCN(CC3)C(=O)[C@@H]4CCCN4C)NC5=NC=C(C(=N5)NC6=CC=CC=C6S(=O)(=O)C(C)C)Cl
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Product OPENEYE NAME: 2-[1-(azetidine-3-carbonyl)-4-piperidyl]-6-[[5-chloro-4-(2-isopropylsulfonylanilino)pyrimidin-2-yl]amino]-5-isopropoxy-isoindolin-1-one
CAS Name: 2-[1-[3-azetidinyl(oxo)methyl]-4-piperidinyl]-6-[[5-chloro-4-(2-propan-2-ylsulfonylanilino)-2-pyrimidinyl]amino]-5-propan-2-yloxy-3H-isoindol-1-one
IUPAC NAME: 2-[1-(azetidine-3-carbonyl)piperidin-4-yl]-6-[[5-chloro-4-(2-propan-2-ylsulfonylanilino)pyrimidin-2-yl]amino]-5-propan-2-yloxy-3H-isoindol-1-one
SYSTEMATIC NAME: 2-[1-(azetidin-3-ylcarbonyl)piperidin-4-yl]-6-[[5-chloranyl-4-[(2-propan-2-ylsulfonylphenyl)amino]pyrimidin-2-yl]amino]-5-propan-2-yloxy-3H-isoindol-1-one
MOLECULAR FORMULA: C33H40ClN7O5S
MOLECULAR WEIGHT: 682.2326
SMILES: CC(C)OC1=C(C=C2C(=C1)CN(C2=O)C3CCN(CC3)C(=O)C4CNC4)NC5=NC=C(C(=N5)NC6=CC=CC=C6S(=O)(=O)C(C)C)Cl
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Product OPENEYE NAME: 6-[[5-chloro-4-(2-isopropylsulfonylanilino)pyrimidin-2-yl]amino]-5-isopropoxy-2-[1-(1-methylazetidine-3-carbonyl)-4-piperidyl]isoindolin-1-one
CAS Name: 6-[[5-chloro-4-(2-propan-2-ylsulfonylanilino)-2-pyrimidinyl]amino]-2-[1-[(1-methyl-3-azetidinyl)-oxomethyl]-4-piperidinyl]-5-propan-2-yloxy-3H-isoindol-1-one
IUPAC NAME: 6-[[5-chloro-4-(2-propan-2-ylsulfonylanilino)pyrimidin-2-yl]amino]-2-[1-(1-methylazetidine-3-carbonyl)piperidin-4-yl]-5-propan-2-yloxy-3H-isoindol-1-one
SYSTEMATIC NAME: 6-[[5-chloranyl-4-[(2-propan-2-ylsulfonylphenyl)amino]pyrimidin-2-yl]amino]-2-[1-(1-methylazetidin-3-yl)carbonylpiperidin-4-yl]-5-propan-2-yloxy-3H-isoindol-1-one
MOLECULAR FORMULA: C34H42ClN7O5S
MOLECULAR WEIGHT: 696.25918
SMILES: CC(C)OC1=C(C=C2C(=C1)CN(C2=O)C3CCN(CC3)C(=O)C4CN(C4)C)NC5=NC=C(C(=N5)NC6=CC=CC=C6S(=O)(=O)C(C)C)Cl
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Product OPENEYE NAME: (2R)-1,1,1-trifluoro-3-[4-[5-isopropoxy-4-[[4-(2-isopropylsulfonylanilino)-5-methyl-7H-pyrrolo[2,3-d]pyrimidin-2-yl]amino]-2-methyl-phenyl]-1-piperidyl]propan-2-ol
CAS Name: (2R)-1,1,1-trifluoro-3-[4-[2-methyl-4-[[5-methyl-4-(2-propan-2-ylsulfonylanilino)-7H-pyrrolo[2,3-d]pyrimidin-2-yl]amino]-5-propan-2-yloxyphenyl]-1-piperidinyl]-2-propanol
IUPAC NAME: (2R)-1,1,1-trifluoro-3-[4-[2-methyl-4-[[5-methyl-4-(2-propan-2-ylsulfonylanilino)-7H-pyrrolo[2,3-d]pyrimidin-2-yl]amino]-5-propan-2-yloxyphenyl]piperidin-1-yl]propan-2-ol
SYSTEMATIC NAME: (2R)-1,1,1-tris(fluoranyl)-3-[4-[2-methyl-4-[[5-methyl-4-[(2-propan-2-ylsulfonylphenyl)amino]-7H-pyrrolo[2,3-d]pyrimidin-2-yl]amino]-5-propan-2-yloxy-phenyl]piperidin-1-yl]propan-2-ol
MOLECULAR FORMULA: C34H43F3N6O4S
MOLECULAR WEIGHT: 688.80323
SMILES: CC1=CC(=C(C=C1C2CCN(CC2)C[C@H](C(F)(F)F)O)OC(C)C)NC3=NC4=C(C(=CN4)C)C(=N3)NC5=CC=CC=C5S(=O)(=O)C(C)C
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Product OPENEYE NAME: N6-[2-isopropoxy-5-methyl-4-(1-methyl-4-piperidyl)phenyl]-1-methyl-N4-(2-methylsulfonylphenyl)pyrazolo[3,4-d]pyrimidine-4,6-diamine
CAS Name: 1-methyl-N6-[5-methyl-4-(1-methyl-4-piperidinyl)-2-propan-2-yloxyphenyl]-N4-(2-methylsulfonylphenyl)pyrazolo[3,4-d]pyrimidine-4,6-diamine
IUPAC NAME: 1-methyl-6-N-[5-methyl-4-(1-methylpiperidin-4-yl)-2-propan-2-yloxyphenyl]-4-N-(2-methylsulfonylphenyl)pyrazolo[3,4-d]pyrimidine-4,6-diamine
SYSTEMATIC NAME: 1-methyl-N6-[5-methyl-4-(1-methylpiperidin-4-yl)-2-propan-2-yloxy-phenyl]-N4-(2-methylsulfonylphenyl)pyrazolo[3,4-d]pyrimidine-4,6-diamine
MOLECULAR FORMULA: C29H37N7O3S
MOLECULAR WEIGHT: 563.71418
SMILES: CC1=CC(=C(C=C1C2CCN(CC2)C)OC(C)C)NC3=NC4=C(C=NN4C)C(=N3)NC5=CC=CC=C5S(=O)(=O)C
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Product OPENEYE NAME: 1-(azetidin-1-yl)-3-[4-[[2-isopropoxy-3-[[4-(2-isopropylsulfonylanilino)-3-methyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl]amino]-5-methyl-phenyl]methyl]-1-piperidyl]propan-1-one
CAS Name: 1-(1-azetidinyl)-3-[4-[[5-methyl-3-[[3-methyl-4-(2-propan-2-ylsulfonylanilino)-2H-pyrazolo[3,4-d]pyrimidin-6-yl]amino]-2-propan-2-yloxyphenyl]methyl]-1-piperidinyl]-1-propanone
IUPAC NAME: 1-(azetidin-1-yl)-3-[4-[[5-methyl-3-[[3-methyl-4-(2-propan-2-ylsulfonylanilino)-2H-pyrazolo[3,4-d]pyrimidin-6-yl]amino]-2-propan-2-yloxyphenyl]methyl]piperidin-1-yl]propan-1-one
SYSTEMATIC NAME: 1-(azetidin-1-yl)-3-[4-[[5-methyl-3-[[3-methyl-4-[(2-propan-2-ylsulfonylphenyl)amino]-2H-pyrazolo[3,4-d]pyrimidin-6-yl]amino]-2-propan-2-yloxy-phenyl]methyl]piperidin-1-yl]propan-1-one
MOLECULAR FORMULA: C37H50N8O4S
MOLECULAR WEIGHT: 702.9091
SMILES: CC1=CC(=C(C(=C1)NC2=NC3=NNC(=C3C(=N2)NC4=CC=CC=C4S(=O)(=O)C(C)C)C)OC(C)C)CC5CCN(CC5)CCC(=O)N6CCC6
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Product OPENEYE NAME: 2-[4-[3-isopropoxy-4-[[4-(2-isopropylsulfonylanilino)-3-methyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl]amino]phenyl]-1-piperidyl]acetamide
CAS Name: 2-[4-[4-[[3-methyl-4-(2-propan-2-ylsulfonylanilino)-2H-pyrazolo[3,4-d]pyrimidin-6-yl]amino]-3-propan-2-yloxyphenyl]-1-piperidinyl]acetamide
IUPAC NAME: 2-[4-[4-[[3-methyl-4-(2-propan-2-ylsulfonylanilino)-2H-pyrazolo[3,4-d]pyrimidin-6-yl]amino]-3-propan-2-yloxyphenyl]piperidin-1-yl]acetamide
SYSTEMATIC NAME: 2-[4-[4-[[3-methyl-4-[(2-propan-2-ylsulfonylphenyl)amino]-2H-pyrazolo[3,4-d]pyrimidin-6-yl]amino]-3-propan-2-yloxy-phenyl]piperidin-1-yl]ethanamide
MOLECULAR FORMULA: C31H40N8O4S
MOLECULAR WEIGHT: 620.7655
SMILES: CC1=C2C(=NN1)N=C(N=C2NC3=CC=CC=C3S(=O)(=O)C(C)C)NC4=C(C=C(C=C4)C5CCN(CC5)CC(=O)N)OC(C)C
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Product OPENEYE NAME: 4-[4-[2-[(1R,2S)-2-[1-(5-chloropyrimidin-2-yl)-4-piperidyl]cyclopropyl]ethoxy]phenyl]isoxazole
CAS Name: 4-[4-[2-[(1R,2S)-2-[1-(5-chloro-2-pyrimidinyl)-4-piperidinyl]cyclopropyl]ethoxy]phenyl]isoxazole
IUPAC NAME: 4-[4-[2-[(1R,2S)-2-[1-(5-chloropyrimidin-2-yl)piperidin-4-yl]cyclopropyl]ethoxy]phenyl]-1,2-oxazole
SYSTEMATIC NAME: 4-[4-[2-[(1R,2S)-2-[1-(5-chloranylpyrimidin-2-yl)piperidin-4-yl]cyclopropyl]ethoxy]phenyl]-1,2-oxazole
MOLECULAR FORMULA: C23H25ClN4O2
MOLECULAR WEIGHT: 424.9232
SMILES: C1CN(CCC1[C@@H]2C[C@@H]2CCOC3=CC=C(C=C3)C4=CON=C4)C5=NC=C(C=N5)Cl
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Product OPENEYE NAME: 5-[4-[2-[(1R,2S)-2-[1-(5-chloropyrimidin-2-yl)-4-piperidyl]cyclopropyl]ethoxy]phenyl]isoxazole
CAS Name: 5-[4-[2-[(1R,2S)-2-[1-(5-chloro-2-pyrimidinyl)-4-piperidinyl]cyclopropyl]ethoxy]phenyl]isoxazole
IUPAC NAME: 5-[4-[2-[(1R,2S)-2-[1-(5-chloropyrimidin-2-yl)piperidin-4-yl]cyclopropyl]ethoxy]phenyl]-1,2-oxazole
SYSTEMATIC NAME: 5-[4-[2-[(1R,2S)-2-[1-(5-chloranylpyrimidin-2-yl)piperidin-4-yl]cyclopropyl]ethoxy]phenyl]-1,2-oxazole
MOLECULAR FORMULA: C23H25ClN4O2
MOLECULAR WEIGHT: 424.9232
SMILES: C1CN(CCC1[C@@H]2C[C@@H]2CCOC3=CC=C(C=C3)C4=CC=NO4)C5=NC=C(C=N5)Cl
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Product OPENEYE NAME: 6-[2-[(1R,2S)-2-[1-(5-chloropyrimidin-2-yl)-4-piperidyl]cyclopropyl]ethoxy]-2-methyl-pyrimidine-4-carbonitrile
CAS Name: 6-[2-[(1R,2S)-2-[1-(5-chloro-2-pyrimidinyl)-4-piperidinyl]cyclopropyl]ethoxy]-2-methyl-4-pyrimidinecarbonitrile
IUPAC NAME: 6-[2-[(1R,2S)-2-[1-(5-chloropyrimidin-2-yl)piperidin-4-yl]cyclopropyl]ethoxy]-2-methylpyrimidine-4-carbonitrile
SYSTEMATIC NAME: 6-[2-[(1R,2S)-2-[1-(5-chloranylpyrimidin-2-yl)piperidin-4-yl]cyclopropyl]ethoxy]-2-methyl-pyrimidine-4-carbonitrile
MOLECULAR FORMULA: C20H23ClN6O
MOLECULAR WEIGHT: 398.88922
SMILES: CC1=NC(=CC(=N1)OCC[C@H]2C[C@H]2C3CCN(CC3)C4=NC=C(C=N4)Cl)C#N
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Product OPENEYE NAME: 2-methyl-6-[2-[(1S,2R)-2-[1-[5-(trifluoromethyl)-2-pyridyl]-4-piperidyl]cyclopropyl]ethoxy]pyrimidine-4-carbonitrile
CAS Name: 2-methyl-6-[2-[(1S,2R)-2-[1-[5-(trifluoromethyl)-2-pyridinyl]-4-piperidinyl]cyclopropyl]ethoxy]-4-pyrimidinecarbonitrile
IUPAC NAME: 2-methyl-6-[2-[(1S,2R)-2-[1-[5-(trifluoromethyl)pyridin-2-yl]piperidin-4-yl]cyclopropyl]ethoxy]pyrimidine-4-carbonitrile
SYSTEMATIC NAME: 2-methyl-6-[2-[(1S,2R)-2-[1-[5-(trifluoromethyl)pyridin-2-yl]piperidin-4-yl]cyclopropyl]ethoxy]pyrimidine-4-carbonitrile
MOLECULAR FORMULA: C22H24F3N5O
MOLECULAR WEIGHT: 431.45407
SMILES: CC1=NC(=CC(=N1)OCC[C@@H]2C[C@@H]2C3CCN(CC3)C4=NC=C(C=C4)C(F)(F)F)C#N
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Product OPENEYE NAME: disodium 2-[3-[[5-(3-ethylsulfonylphenyl)-3-methyl-9H-pyrido[2,3-b]indol-8-yl]oxy]propyl-(2,2,2-trifluoroethyl)amino]ethyl phosphate
CAS Name: disodium 2-[3-[[5-(3-ethylsulfonylphenyl)-3-methyl-9H-pyrido[2,3-b]indol-8-yl]oxy]propyl-(2,2,2-trifluoroethyl)amino]ethyl phosphate
IUPAC NAME: disodium 2-[3-[[5-(3-ethylsulfonylphenyl)-3-methyl-9H-pyrido[2,3-b]indol-8-yl]oxy]propyl-(2,2,2-trifluoroethyl)amino]ethyl phosphate
SYSTEMATIC NAME: disodium 2-[3-[[5-(3-ethylsulfonylphenyl)-3-methyl-9H-pyrido[2,3-b]indol-8-yl]oxy]propyl-[2,2,2-tris(fluoranyl)ethyl]amino]ethyl phosphate
MOLECULAR FORMULA: C27H29F3N3Na2O7PS
MOLECULAR WEIGHT: 673.548571
SMILES: CCS(=O)(=O)C1=CC=CC(=C1)C2=C3C4=CC(=CN=C4NC3=C(C=C2)OCCCN(CCOP(=O)([O-])[O-])CC(F)(F)F)C.[Na+].[Na+]
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