Product OPENEYE NAME: 2-(4-chlorophenyl)-1-methyl-3-phenyl-hexahydropyrimidin-2-ol
CAS Name: 2-(4-chlorophenyl)-1-methyl-3-phenyl-1,3-diazinan-2-ol
IUPAC NAME: 2-(4-chlorophenyl)-1-methyl-3-phenyl-1,3-diazinan-2-ol
SYSTEMATIC NAME: 2-(4-chlorophenyl)-1-methyl-3-phenyl-1,3-diazinan-2-ol
MOLECULAR FORMULA: C17H19ClN2O
MOLECULAR WEIGHT: 302.79856
SMILES: CN1CCCN(C1(C2=CC=C(C=C2)Cl)O)C3=CC=CC=C3
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Product OPENEYE NAME: N-phenyl-10H-phenothiazin-3-amine
CAS Name: N-phenyl-10H-phenothiazin-3-amine
IUPAC NAME: N-phenyl-10H-phenothiazin-3-amine
SYSTEMATIC NAME: N-phenyl-10H-phenothiazin-3-amine
MOLECULAR FORMULA: C18H14N2S
MOLECULAR WEIGHT: 290.38216
SMILES: C1=CC=C(C=C1)NC2=CC3=C(C=C2)NC4=CC=CC=C4S3
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Product OPENEYE NAME: N3,N7-diphenyl-10H-phenothiazine-3,7-diamine
CAS Name: N3,N7-diphenyl-10H-phenothiazine-3,7-diamine
IUPAC NAME: 3-N,7-N-diphenyl-10H-phenothiazine-3,7-diamine
SYSTEMATIC NAME: N3,N7-diphenyl-10H-phenothiazine-3,7-diamine
MOLECULAR FORMULA: C24H19N3S
MOLECULAR WEIGHT: 381.49276
SMILES: C1=CC=C(C=C1)NC2=CC3=C(C=C2)NC4=C(S3)C=C(C=C4)NC5=CC=CC=C5
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Product OPENEYE NAME: ethyl [(E)-(8-methyl-1-oxo-[1,2,4]oxadiazolo[3,4-c][1,4]benzoxazin-4-ylidene)amino] carbonate
CAS Name: carbonic acid ethyl [(E)-(8-methyl-1-oxo-[1,2,4]oxadiazolo[3,4-c][1,4]benzoxazin-4-ylidene)amino] ester
IUPAC NAME: ethyl [(E)-(8-methyl-1-oxo-[1,2,4]oxadiazolo[3,4-c][1,4]benzoxazin-4-ylidene)amino] carbonate
SYSTEMATIC NAME: ethyl [(E)-(8-methyl-1-oxidanylidene-[1,2,4]oxadiazolo[3,4-c][1,4]benzoxazin-4-ylidene)amino] carbonate
MOLECULAR FORMULA: C13H11N3O6
MOLECULAR WEIGHT: 305.24294
SMILES: CCOC(=O)O/N=C/1\C2=NOC(=O)N2C3=C(O1)C=CC(=C3)C
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Product OPENEYE NAME: ethyl [(E)-(7-methyl-1-oxo-[1,2,4]oxadiazolo[3,4-c][1,4]benzoxazin-4-ylidene)amino] carbonate
CAS Name: carbonic acid ethyl [(E)-(7-methyl-1-oxo-[1,2,4]oxadiazolo[3,4-c][1,4]benzoxazin-4-ylidene)amino] ester
IUPAC NAME: ethyl [(E)-(7-methyl-1-oxo-[1,2,4]oxadiazolo[3,4-c][1,4]benzoxazin-4-ylidene)amino] carbonate
SYSTEMATIC NAME: ethyl [(E)-(7-methyl-1-oxidanylidene-[1,2,4]oxadiazolo[3,4-c][1,4]benzoxazin-4-ylidene)amino] carbonate
MOLECULAR FORMULA: C13H11N3O6
MOLECULAR WEIGHT: 305.24294
SMILES: CCOC(=O)O/N=C/1\C2=NOC(=O)N2C3=C(O1)C=C(C=C3)C
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Product OPENEYE NAME: [(E)-(8-chloro-1-oxo-[1,2,4]oxadiazolo[3,4-c][1,4]benzoxazin-4-ylidene)amino] ethyl carbonate
CAS Name: carbonic acid [(E)-(8-chloro-1-oxo-[1,2,4]oxadiazolo[3,4-c][1,4]benzoxazin-4-ylidene)amino] ethyl ester
IUPAC NAME: [(E)-(8-chloro-1-oxo-[1,2,4]oxadiazolo[3,4-c][1,4]benzoxazin-4-ylidene)amino] ethyl carbonate
SYSTEMATIC NAME: [(E)-(8-chloranyl-1-oxidanylidene-[1,2,4]oxadiazolo[3,4-c][1,4]benzoxazin-4-ylidene)amino] ethyl carbonate
MOLECULAR FORMULA: C12H8ClN3O6
MOLECULAR WEIGHT: 325.66142
SMILES: CCOC(=O)O/N=C/1\C2=NOC(=O)N2C3=C(O1)C=CC(=C3)Cl
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Product OPENEYE NAME: [(E)-[3-(ethoxycarbonyloxyamino)-6-methyl-1,4-benzoxazin-2-ylidene]amino] ethyl carbonate
CAS Name: carbonic acid [(E)-[3-(ethoxycarbonyloxyamino)-6-methyl-1,4-benzoxazin-2-ylidene]amino] ethyl ester
IUPAC NAME: [(E)-[3-(ethoxycarbonyloxyamino)-6-methyl-1,4-benzoxazin-2-ylidene]amino] ethyl carbonate
SYSTEMATIC NAME: [(E)-[3-(ethoxycarbonyloxyamino)-6-methyl-1,4-benzoxazin-2-ylidene]amino] ethyl carbonate
MOLECULAR FORMULA: C15H17N3O7
MOLECULAR WEIGHT: 351.31138
SMILES: CCOC(=O)ONC\1=NC2=C(C=CC(=C2)C)O/C1=N/OC(=O)OCC
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Product OPENEYE NAME: [(E)-[6-chloro-3-(ethoxycarbonyloxyamino)-1,4-benzoxazin-2-ylidene]amino] ethyl carbonate
CAS Name: carbonic acid [(E)-[6-chloro-3-(ethoxycarbonyloxyamino)-1,4-benzoxazin-2-ylidene]amino] ethyl ester
IUPAC NAME: [(E)-[6-chloro-3-(ethoxycarbonyloxyamino)-1,4-benzoxazin-2-ylidene]amino] ethyl carbonate
SYSTEMATIC NAME: [(E)-[6-chloranyl-3-(ethoxycarbonyloxyamino)-1,4-benzoxazin-2-ylidene]amino] ethyl carbonate
MOLECULAR FORMULA: C14H14ClN3O7
MOLECULAR WEIGHT: 371.72986
SMILES: CCOC(=O)ONC\1=NC2=C(C=CC(=C2)Cl)O/C1=N/OC(=O)OCC
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Product OPENEYE NAME: ethyl (2S,3R,4R,5R)-2,4-dimethyl-2-phenyl-6-oxa-1-azabicyclo[3.1.0]hexane-3-carboxylate
CAS Name: (2S,3R,4R,5R)-2,4-dimethyl-2-phenyl-6-oxa-1-azabicyclo[3.1.0]hexane-3-carboxylic acid ethyl ester
IUPAC NAME: ethyl (2S,3R,4R,5R)-2,4-dimethyl-2-phenyl-6-oxa-1-azabicyclo[3.1.0]hexane-3-carboxylate
SYSTEMATIC NAME: ethyl (2S,3R,4R,5R)-2,4-dimethyl-2-phenyl-6-oxa-1-azabicyclo[3.1.0]hexane-3-carboxylate
MOLECULAR FORMULA: C15H19NO3
MOLECULAR WEIGHT: 261.31626
SMILES: CCOC(=O)[C@@H]1[C@H]([C@@H]2N([C@]1(C)C3=CC=CC=C3)O2)C
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Product OPENEYE NAME: ethyl (2S,3R,5R)-2,4,4-trimethyl-2-phenyl-6-oxa-1-azabicyclo[3.1.0]hexane-3-carboxylate
CAS Name: (2S,3R,5R)-2,4,4-trimethyl-2-phenyl-6-oxa-1-azabicyclo[3.1.0]hexane-3-carboxylic acid ethyl ester
IUPAC NAME: ethyl (2S,3R,5R)-2,4,4-trimethyl-2-phenyl-6-oxa-1-azabicyclo[3.1.0]hexane-3-carboxylate
SYSTEMATIC NAME: ethyl (2S,3R,5R)-2,4,4-trimethyl-2-phenyl-6-oxa-1-azabicyclo[3.1.0]hexane-3-carboxylate
MOLECULAR FORMULA: C16H21NO3
MOLECULAR WEIGHT: 275.34284
SMILES: CCOC(=O)[C@H]1[C@@](N2[C@@H](C1(C)C)O2)(C)C3=CC=CC=C3
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Product OPENEYE NAME: ethyl (2S,3R,5R)-2-isopropyl-2,4,4-trimethyl-6-oxa-1-azabicyclo[3.1.0]hexane-3-carboxylate
CAS Name: (2S,3R,5R)-2,4,4-trimethyl-2-propan-2-yl-6-oxa-1-azabicyclo[3.1.0]hexane-3-carboxylic acid ethyl ester
IUPAC NAME: ethyl (2S,3R,5R)-2,4,4-trimethyl-2-propan-2-yl-6-oxa-1-azabicyclo[3.1.0]hexane-3-carboxylate
SYSTEMATIC NAME: ethyl (2S,3R,5R)-2,4,4-trimethyl-2-propan-2-yl-6-oxa-1-azabicyclo[3.1.0]hexane-3-carboxylate
MOLECULAR FORMULA: C13H23NO3
MOLECULAR WEIGHT: 241.32662
SMILES: CCOC(=O)[C@H]1[C@](N2[C@@H](C1(C)C)O2)(C)C(C)C
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Product OPENEYE NAME: ethyl 2-hydroxy-1,3,3-trimethyl-5-phenyl-2H-pyrrole-4-carboxylate
CAS Name: 2-hydroxy-1,3,3-trimethyl-5-phenyl-2H-pyrrole-4-carboxylic acid ethyl ester
IUPAC NAME: ethyl 2-hydroxy-1,3,3-trimethyl-5-phenyl-2H-pyrrole-4-carboxylate
SYSTEMATIC NAME: ethyl 1,3,3-trimethyl-2-oxidanyl-5-phenyl-2H-pyrrole-4-carboxylate
MOLECULAR FORMULA: C16H21NO3
MOLECULAR WEIGHT: 275.34284
SMILES: CCOC(=O)C1=C(N(C(C1(C)C)O)C)C2=CC=CC=C2
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Product OPENEYE NAME: ethyl 2-hydroxy-5-isopropyl-1,3,3-trimethyl-2H-pyrrole-4-carboxylate
CAS Name: 2-hydroxy-1,3,3-trimethyl-5-propan-2-yl-2H-pyrrole-4-carboxylic acid ethyl ester
IUPAC NAME: ethyl 2-hydroxy-1,3,3-trimethyl-5-propan-2-yl-2H-pyrrole-4-carboxylate
SYSTEMATIC NAME: ethyl 1,3,3-trimethyl-2-oxidanyl-5-propan-2-yl-2H-pyrrole-4-carboxylate
MOLECULAR FORMULA: C13H23NO3
MOLECULAR WEIGHT: 241.32662
SMILES: CCOC(=O)C1=C(N(C(C1(C)C)O)C)C(C)C
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Product OPENEYE NAME: ethyl 3-hydroxyspiro[3,5,6,7,8,9-hexahydropyrrolo[1,2-a]azepine-2,1'-cyclohexane]-1-carboxylate
CAS Name: 3-hydroxy-1-spiro[3,5,6,7,8,9-hexahydropyrrolo[1,2-a]azepine-2,1'-cyclohexane]carboxylic acid ethyl ester
IUPAC NAME: ethyl 3-hydroxyspiro[3,5,6,7,8,9-hexahydropyrrolo[1,2-a]azepine-2,1'-cyclohexane]-1-carboxylate
SYSTEMATIC NAME: ethyl 3-oxidanylspiro[3,5,6,7,8,9-hexahydropyrrolo[1,2-a]azepine-2,1'-cyclohexane]-1-carboxylate
MOLECULAR FORMULA: C17H27NO3
MOLECULAR WEIGHT: 293.40118
SMILES: CCOC(=O)C1=C2CCCCCN2C(C13CCCCC3)O
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Product OPENEYE NAME: ethyl 2,4-dimethyl-1-phenyl-pyrrole-3-carboxylate
CAS Name: 2,4-dimethyl-1-phenyl-3-pyrrolecarboxylic acid ethyl ester
IUPAC NAME: ethyl 2,4-dimethyl-1-phenylpyrrole-3-carboxylate
SYSTEMATIC NAME: ethyl 2,4-dimethyl-1-phenyl-pyrrole-3-carboxylate
MOLECULAR FORMULA: C15H17NO2
MOLECULAR WEIGHT: 243.30098
SMILES: CCOC(=O)C1=C(N(C=C1C)C2=CC=CC=C2)C
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Product OPENEYE NAME: methyl 3-methyl-5-oxo-[1,2,4]triazolo[3,4-b][1,3]thiazine-7-carboxylate
CAS Name: 3-methyl-5-oxo-[1,2,4]triazolo[3,4-b][1,3]thiazine-7-carboxylic acid methyl ester
IUPAC NAME: methyl 3-methyl-5-oxo-[1,2,4]triazolo[3,4-b][1,3]thiazine-7-carboxylate
SYSTEMATIC NAME: methyl 3-methyl-5-oxidanylidene-[1,2,4]triazolo[3,4-b][1,3]thiazine-7-carboxylate
MOLECULAR FORMULA: C8H7N3O3S
MOLECULAR WEIGHT: 225.22448
SMILES: CC1=NN=C2N1C(=O)C=C(S2)C(=O)OC
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Product OPENEYE NAME: tris[[(2S)-1-isobutoxycarbonylpyrrolidine-2-carbonyl]oxy]boranuide
CAS Name: tris[[(2S)-1-[2-methylpropoxy(oxo)methyl]-2-pyrrolidinyl]-oxomethoxy]boranuide
IUPAC NAME: tris[[(2S)-1-(2-methylpropoxycarbonyl)pyrrolidine-2-carbonyl]oxy]boranuide
SYSTEMATIC NAME: tris[[(2S)-1-(2-methylpropoxycarbonyl)pyrrolidin-2-yl]carbonyloxy]boranuide
MOLECULAR FORMULA: C30H49BN3O12-
MOLECULAR WEIGHT: 654.53396
SMILES: [BH-](OC(=O)[C@@H]1CCCN1C(=O)OCC(C)C)(OC(=O)[C@@H]2CCCN2C(=O)OCC(C)C)OC(=O)[C@@H]3CCCN3C(=O)OCC(C)C
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Product OPENEYE NAME: tris[[(2S)-1-(2-ethylhexoxycarbonyl)pyrrolidine-2-carbonyl]oxy]boranuide
CAS Name: tris[[(2S)-1-[2-ethylhexoxy(oxo)methyl]-2-pyrrolidinyl]-oxomethoxy]boranuide
IUPAC NAME: tris[[(2S)-1-(2-ethylhexoxycarbonyl)pyrrolidine-2-carbonyl]oxy]boranuide
SYSTEMATIC NAME: tris[[(2S)-1-(2-ethylhexoxycarbonyl)pyrrolidin-2-yl]carbonyloxy]boranuide
MOLECULAR FORMULA: C42H73BN3O12-
MOLECULAR WEIGHT: 822.85292
SMILES: [BH-](OC(=O)[C@@H]1CCCN1C(=O)OCC(CC)CCCC)(OC(=O)[C@@H]2CCCN2C(=O)OCC(CC)CCCC)OC(=O)[C@@H]3CCCN3C(=O)OCC(CC)CCCC
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Product OPENEYE NAME: tris[[(2S)-1-ethoxycarbonylpyrrolidine-2-carbonyl]oxy]boranuide
CAS Name: tris[[(2S)-1-ethoxycarbonyl-2-pyrrolidinyl]-oxomethoxy]boranuide
IUPAC NAME: tris[[(2S)-1-ethoxycarbonylpyrrolidine-2-carbonyl]oxy]boranuide
SYSTEMATIC NAME: tris[[(2S)-1-ethoxycarbonylpyrrolidin-2-yl]carbonyloxy]boranuide
MOLECULAR FORMULA: C24H37BN3O12-
MOLECULAR WEIGHT: 570.37448
SMILES: [BH-](OC(=O)[C@@H]1CCCN1C(=O)OCC)(OC(=O)[C@@H]2CCCN2C(=O)OCC)OC(=O)[C@@H]3CCCN3C(=O)OCC
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Product OPENEYE NAME: tris[[(2S)-1-propanoylpyrrolidine-2-carbonyl]oxy]boranuide
CAS Name: tris[oxo-[(2S)-1-(1-oxopropyl)-2-pyrrolidinyl]methoxy]boranuide
IUPAC NAME: tris[[(2S)-1-propanoylpyrrolidine-2-carbonyl]oxy]boranuide
SYSTEMATIC NAME: tris[[(2S)-1-propanoylpyrrolidin-2-yl]carbonyloxy]boranuide
MOLECULAR FORMULA: C24H37BN3O9-
MOLECULAR WEIGHT: 522.37628
SMILES: [BH-](OC(=O)[C@@H]1CCCN1C(=O)CC)(OC(=O)[C@@H]2CCCN2C(=O)CC)OC(=O)[C@@H]3CCCN3C(=O)CC
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Product OPENEYE NAME: tris[[1-(p-tolylsulfonyl)pyrrolidine-2-carbonyl]oxy]boranuide
CAS Name: tris[[1-(4-methylphenyl)sulfonyl-2-pyrrolidinyl]-oxomethoxy]boranuide
IUPAC NAME: tris[[1-(4-methylphenyl)sulfonylpyrrolidine-2-carbonyl]oxy]boranuide
SYSTEMATIC NAME: tris[[1-(4-methylphenyl)sulfonylpyrrolidin-2-yl]carbonyloxy]boranuide
MOLECULAR FORMULA: C36H43BN3O12S3-
MOLECULAR WEIGHT: 816.74552
SMILES: [BH-](OC(=O)C1CCCN1S(=O)(=O)C2=CC=C(C=C2)C)(OC(=O)C3CCCN3S(=O)(=O)C4=CC=C(C=C4)C)OC(=O)C5CCCN5S(=O)(=O)C6=CC=C(C=C6)C
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Product OPENEYE NAME: tris[[(2S)-2-(isobutoxycarbonylamino)-3-phenyl-propanoyl]oxy]boranuide
CAS Name: tris[(2S)-2-[[2-methylpropoxy(oxo)methyl]amino]-1-oxo-3-phenylpropoxy]boranuide
IUPAC NAME: tris[[(2S)-2-(2-methylpropoxycarbonylamino)-3-phenylpropanoyl]oxy]boranuide
SYSTEMATIC NAME: tris[[(2S)-2-(2-methylpropoxycarbonylamino)-3-phenyl-propanoyl]oxy]boranuide
MOLECULAR FORMULA: C42H55BN3O12-
MOLECULAR WEIGHT: 804.71
SMILES: [BH-](OC(=O)[C@H](CC1=CC=CC=C1)NC(=O)OCC(C)C)(OC(=O)[C@H](CC2=CC=CC=C2)NC(=O)OCC(C)C)OC(=O)[C@H](CC3=CC=CC=C3)NC(=O)OCC(C)C
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Product OPENEYE NAME: tris[[(2S)-2-(isobutoxycarbonylamino)-3-methyl-butanoyl]oxy]boranuide
CAS Name: tris[(2S)-3-methyl-2-[[2-methylpropoxy(oxo)methyl]amino]-1-oxobutoxy]boranuide
IUPAC NAME: tris[[(2S)-3-methyl-2-(2-methylpropoxycarbonylamino)butanoyl]oxy]boranuide
SYSTEMATIC NAME: tris[[(2S)-3-methyl-2-(2-methylpropoxycarbonylamino)butanoyl]oxy]boranuide
MOLECULAR FORMULA: C30H55BN3O12-
MOLECULAR WEIGHT: 660.5816
SMILES: [BH-](OC(=O)[C@H](C(C)C)NC(=O)OCC(C)C)(OC(=O)[C@H](C(C)C)NC(=O)OCC(C)C)OC(=O)[C@H](C(C)C)NC(=O)OCC(C)C
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