CAS RN: 115204-54-1
CAS Name: 2-chloro-9-[(4-chlorophenyl)methyl]-N,N-dimethyl-6-purinamine
OPENEYE Name: 2-chloro-9-[(4-chlorophenyl)methyl]-N,N-dimethyl-purin-6-amine
IUPAC Name: 2-chloro-9-[(4-chlorophenyl)methyl]-N,N-dimethylpurin-6-amine
SYSTEMATIC NAME: 2-chloranyl-9-[(4-chlorophenyl)methyl]-N,N-dimethyl-purin-6-amine
MOLECULAR FORMULA: C14H13Cl2N5
MOLECULAR WEIGHT: 322.19252
SMILES: CN(C)C1=NC(=NC2=C1N=CN2CC3=CC=C(C=C3)Cl)Cl
Structure:
CAS RN: 115204-53-0
CAS Name: 2-chloro-N,N-dimethyl-9-(phenylmethyl)-6-purinamine
OPENEYE Name: 9-benzyl-2-chloro-N,N-dimethyl-purin-6-amine
IUPAC Name: 9-benzyl-2-chloro-N,N-dimethylpurin-6-amine
SYSTEMATIC NAME: 2-chloranyl-N,N-dimethyl-9-(phenylmethyl)purin-6-amine
MOLECULAR FORMULA: C14H14ClN5
MOLECULAR WEIGHT: 287.74746
SMILES: CN(C)C1=NC(=NC2=C1N=CN2CC3=CC=CC=C3)Cl
Structure:
CAS RN: 112089-22-2
CAS Name: N,N-dimethyl-9-[(3-phenylmethoxyphenyl)methyl]-6-purinamine
OPENEYE Name: 9-[(3-benzyloxyphenyl)methyl]-N,N-dimethyl-purin-6-amine
IUPAC Name: N,N-dimethyl-9-[(3-phenylmethoxyphenyl)methyl]purin-6-amine
SYSTEMATIC NAME: N,N-dimethyl-9-[(3-phenylmethoxyphenyl)methyl]purin-6-amine
MOLECULAR FORMULA: C21H21N5O
MOLECULAR WEIGHT: 359.42434
SMILES: CN(C)C1=NC=NC2=C1N=CN2CC3=CC(=CC=C3)OCC4=CC=CC=C4
Structure:
CAS RN: 115204-52-9
CAS Name: 3-[[6-(dimethylamino)-9-purinyl]methyl]phenol
OPENEYE Name: 3-[[6-(dimethylamino)purin-9-yl]methyl]phenol
IUPAC Name: 3-[[6-(dimethylamino)purin-9-yl]methyl]phenol
SYSTEMATIC NAME: 3-[[6-(dimethylamino)purin-9-yl]methyl]phenol
MOLECULAR FORMULA: C14H15N5O
MOLECULAR WEIGHT: 269.3018
SMILES: CN(C)C1=NC=NC2=C1N=CN2CC3=CC(=CC=C3)O
Structure:
CAS RN: 112089-20-0
CAS Name: 3-[[6-(dimethylamino)-9-purinyl]methyl]benzonitrile
OPENEYE Name: 3-[[6-(dimethylamino)purin-9-yl]methyl]benzonitrile
IUPAC Name: 3-[[6-(dimethylamino)purin-9-yl]methyl]benzonitrile
SYSTEMATIC NAME: 3-[[6-(dimethylamino)purin-9-yl]methyl]benzenecarbonitrile
MOLECULAR FORMULA: C15H14N6
MOLECULAR WEIGHT: 278.31186
SMILES: CN(C)C1=NC=NC2=C1N=CN2CC3=CC=CC(=C3)C#N
Structure:
CAS RN: 7008-56-2
CAS Name: N,N-dimethyl-9-[(3-nitrophenyl)methyl]-6-purinamine
OPENEYE Name: N,N-dimethyl-9-[(3-nitrophenyl)methyl]purin-6-amine
IUPAC Name: N,N-dimethyl-9-[(3-nitrophenyl)methyl]purin-6-amine
SYSTEMATIC NAME: N,N-dimethyl-9-[(3-nitrophenyl)methyl]purin-6-amine
MOLECULAR FORMULA: C14H14N6O2
MOLECULAR WEIGHT: 298.29996
SMILES: CN(C)C1=NC=NC2=C1N=CN2CC3=CC(=CC=C3)[N+](=O)[O-]
Structure:
CAS RN: 112089-19-7
CAS Name: 9-[(3-methoxyphenyl)methyl]-N,N-dimethyl-6-purinamine
OPENEYE Name: 9-[(3-methoxyphenyl)methyl]-N,N-dimethyl-purin-6-amine
IUPAC Name: 9-[(3-methoxyphenyl)methyl]-N,N-dimethylpurin-6-amine
SYSTEMATIC NAME: 9-[(3-methoxyphenyl)methyl]-N,N-dimethyl-purin-6-amine
MOLECULAR FORMULA: C15H17N5O
MOLECULAR WEIGHT: 283.32838
SMILES: CN(C)C1=NC=NC2=C1N=CN2CC3=CC(=CC=C3)OC
Structure:
CAS RN: 112089-18-6
CAS Name: 9-[(3-fluorophenyl)methyl]-N,N-dimethyl-6-purinamine
OPENEYE Name: 9-[(3-fluorophenyl)methyl]-N,N-dimethyl-purin-6-amine
IUPAC Name: 9-[(3-fluorophenyl)methyl]-N,N-dimethylpurin-6-amine
SYSTEMATIC NAME: 9-[(3-fluorophenyl)methyl]-N,N-dimethyl-purin-6-amine
MOLECULAR FORMULA: C14H14FN5
MOLECULAR WEIGHT: 271.292863
SMILES: CN(C)C1=NC=NC2=C1N=CN2CC3=CC(=CC=C3)F
Structure:
CAS RN: 112089-17-5
CAS Name: N,N-dimethyl-9-[(3-methylphenyl)methyl]-6-purinamine
OPENEYE Name: N,N-dimethyl-9-(m-tolylmethyl)purin-6-amine
IUPAC Name: N,N-dimethyl-9-[(3-methylphenyl)methyl]purin-6-amine
SYSTEMATIC NAME: N,N-dimethyl-9-[(3-methylphenyl)methyl]purin-6-amine
MOLECULAR FORMULA: C15H17N5
MOLECULAR WEIGHT: 267.32898
SMILES: CC1=CC(=CC=C1)CN2C=NC3=C2N=CN=C3N(C)C
Structure:
CAS RN: 112089-16-4
CAS Name: 9-[(3,4-dichlorophenyl)methyl]-N,N-dimethyl-6-purinamine
OPENEYE Name: 9-[(3,4-dichlorophenyl)methyl]-N,N-dimethyl-purin-6-amine
IUPAC Name: 9-[(3,4-dichlorophenyl)methyl]-N,N-dimethylpurin-6-amine
SYSTEMATIC NAME: 9-[(3,4-dichlorophenyl)methyl]-N,N-dimethyl-purin-6-amine
MOLECULAR FORMULA: C14H13Cl2N5
MOLECULAR WEIGHT: 322.19252
SMILES: CN(C)C1=NC=NC2=C1N=CN2CC3=CC(=C(C=C3)Cl)Cl
Structure:
CAS RN: 112089-15-3
CAS Name: 9-[(3,5-dichlorophenyl)methyl]-N,N-dimethyl-6-purinamine
OPENEYE Name: 9-[(3,5-dichlorophenyl)methyl]-N,N-dimethyl-purin-6-amine
IUPAC Name: 9-[(3,5-dichlorophenyl)methyl]-N,N-dimethylpurin-6-amine
SYSTEMATIC NAME: 9-[[3,5-bis(chloranyl)phenyl]methyl]-N,N-dimethyl-purin-6-amine
MOLECULAR FORMULA: C14H13Cl2N5
MOLECULAR WEIGHT: 322.19252
SMILES: CN(C)C1=NC=NC2=C1N=CN2CC3=CC(=CC(=C3)Cl)Cl
Structure:
CAS RN: 112089-14-2
CAS Name: 9-[(3-chlorophenyl)methyl]-N,N-dimethyl-6-purinamine
OPENEYE Name: 9-[(3-chlorophenyl)methyl]-N,N-dimethyl-purin-6-amine
IUPAC Name: 9-[(3-chlorophenyl)methyl]-N,N-dimethylpurin-6-amine
SYSTEMATIC NAME: 9-[(3-chlorophenyl)methyl]-N,N-dimethyl-purin-6-amine
MOLECULAR FORMULA: C14H14ClN5
MOLECULAR WEIGHT: 287.74746
SMILES: CN(C)C1=NC=NC2=C1N=CN2CC3=CC(=CC=C3)Cl
Structure:
CAS RN: 112089-12-0
CAS Name: 9-[(3-iodophenyl)methyl]-N,N-dimethyl-6-purinamine
OPENEYE Name: 9-[(3-iodophenyl)methyl]-N,N-dimethyl-purin-6-amine
IUPAC Name: 9-[(3-iodophenyl)methyl]-N,N-dimethylpurin-6-amine
SYSTEMATIC NAME: 9-[(3-iodanylphenyl)methyl]-N,N-dimethyl-purin-6-amine
MOLECULAR FORMULA: C14H14IN5
MOLECULAR WEIGHT: 379.19893
SMILES: CN(C)C1=NC=NC2=C1N=CN2CC3=CC(=CC=C3)I
Structure:
CAS RN: 112089-11-9
CAS Name: N,N-dimethyl-9-[[3-(trifluoromethyl)phenyl]methyl]-6-purinamine
OPENEYE Name: N,N-dimethyl-9-[[3-(trifluoromethyl)phenyl]methyl]purin-6-amine
IUPAC Name: N,N-dimethyl-9-[[3-(trifluoromethyl)phenyl]methyl]purin-6-amine
SYSTEMATIC NAME: N,N-dimethyl-9-[[3-(trifluoromethyl)phenyl]methyl]purin-6-amine
MOLECULAR FORMULA: C15H14F3N5
MOLECULAR WEIGHT: 321.30037
SMILES: CN(C)C1=NC=NC2=C1N=CN2CC3=CC(=CC=C3)C(F)(F)F
Structure:
CAS RN: 112089-10-8
CAS Name: 9-[(4-aminophenyl)methyl]-N,N-dimethyl-6-purinamine
OPENEYE Name: 9-[(4-aminophenyl)methyl]-N,N-dimethyl-purin-6-amine
IUPAC Name: 9-[(4-aminophenyl)methyl]-N,N-dimethylpurin-6-amine
SYSTEMATIC NAME: 9-[(4-aminophenyl)methyl]-N,N-dimethyl-purin-6-amine
MOLECULAR FORMULA: C14H16N6
MOLECULAR WEIGHT: 268.31704
SMILES: CN(C)C1=NC=NC2=C1N=CN2CC3=CC=C(C=C3)N
Structure:
CAS RN: 115204-51-8
CAS Name: N-[4-[[6-(dimethylamino)-9-purinyl]methyl]phenyl]acetamide
OPENEYE Name: N-[4-[[6-(dimethylamino)purin-9-yl]methyl]phenyl]acetamide
IUPAC Name: N-[4-[[6-(dimethylamino)purin-9-yl]methyl]phenyl]acetamide
SYSTEMATIC NAME: N-[4-[[6-(dimethylamino)purin-9-yl]methyl]phenyl]ethanamide
MOLECULAR FORMULA: C16H18N6O
MOLECULAR WEIGHT: 310.35372
SMILES: CC(=O)NC1=CC=C(C=C1)CN2C=NC3=C2N=CN=C3N(C)C
Structure:
CAS RN: 112089-09-5
CAS Name: N,N-dimethyl-9-[(4-phenylmethoxyphenyl)methyl]-6-purinamine
OPENEYE Name: 9-[(4-benzyloxyphenyl)methyl]-N,N-dimethyl-purin-6-amine
IUPAC Name: N,N-dimethyl-9-[(4-phenylmethoxyphenyl)methyl]purin-6-amine
SYSTEMATIC NAME: N,N-dimethyl-9-[(4-phenylmethoxyphenyl)methyl]purin-6-amine
MOLECULAR FORMULA: C21H21N5O
MOLECULAR WEIGHT: 359.42434
SMILES: CN(C)C1=NC=NC2=C1N=CN2CC3=CC=C(C=C3)OCC4=CC=CC=C4
Structure:
CAS RN: 112089-08-4
CAS Name: 4-[[6-(dimethylamino)-9-purinyl]methyl]phenol
OPENEYE Name: 4-[[6-(dimethylamino)purin-9-yl]methyl]phenol
IUPAC Name: 4-[[6-(dimethylamino)purin-9-yl]methyl]phenol
SYSTEMATIC NAME: 4-[[6-(dimethylamino)purin-9-yl]methyl]phenol
MOLECULAR FORMULA: C14H15N5O
MOLECULAR WEIGHT: 269.3018
SMILES: CN(C)C1=NC=NC2=C1N=CN2CC3=CC=C(C=C3)O
Structure:
CAS RN: 112089-07-3
CAS Name: 4-[[6-(dimethylamino)-9-purinyl]methyl]benzonitrile
OPENEYE Name: 4-[[6-(dimethylamino)purin-9-yl]methyl]benzonitrile
IUPAC Name: 4-[[6-(dimethylamino)purin-9-yl]methyl]benzonitrile
SYSTEMATIC NAME: 4-[[6-(dimethylamino)purin-9-yl]methyl]benzenecarbonitrile
MOLECULAR FORMULA: C15H14N6
MOLECULAR WEIGHT: 278.31186
SMILES: CN(C)C1=NC=NC2=C1N=CN2CC3=CC=C(C=C3)C#N
Structure:
CAS RN: 13233-85-7
CAS Name: N,N-dimethyl-9-[(4-nitrophenyl)methyl]-6-purinamine
OPENEYE Name: N,N-dimethyl-9-[(4-nitrophenyl)methyl]purin-6-amine
IUPAC Name: N,N-dimethyl-9-[(4-nitrophenyl)methyl]purin-6-amine
SYSTEMATIC NAME: N,N-dimethyl-9-[(4-nitrophenyl)methyl]purin-6-amine
MOLECULAR FORMULA: C14H14N6O2
MOLECULAR WEIGHT: 298.29996
SMILES: CN(C)C1=NC=NC2=C1N=CN2CC3=CC=C(C=C3)[N+](=O)[O-]
Structure:
CAS RN: 112089-06-2
CAS Name: 9-[(4-methoxyphenyl)methyl]-N,N-dimethyl-6-purinamine
OPENEYE Name: 9-[(4-methoxyphenyl)methyl]-N,N-dimethyl-purin-6-amine
IUPAC Name: 9-[(4-methoxyphenyl)methyl]-N,N-dimethylpurin-6-amine
SYSTEMATIC NAME: 9-[(4-methoxyphenyl)methyl]-N,N-dimethyl-purin-6-amine
MOLECULAR FORMULA: C15H17N5O
MOLECULAR WEIGHT: 283.32838
SMILES: CN(C)C1=NC=NC2=C1N=CN2CC3=CC=C(C=C3)OC
Structure:
CAS RN: 112089-05-1
CAS Name: 9-[(4-fluorophenyl)methyl]-N,N-dimethyl-6-purinamine
OPENEYE Name: 9-[(4-fluorophenyl)methyl]-N,N-dimethyl-purin-6-amine
IUPAC Name: 9-[(4-fluorophenyl)methyl]-N,N-dimethylpurin-6-amine
SYSTEMATIC NAME: 9-[(4-fluorophenyl)methyl]-N,N-dimethyl-purin-6-amine
MOLECULAR FORMULA: C14H14FN5
MOLECULAR WEIGHT: 271.292863
SMILES: CN(C)C1=NC=NC2=C1N=CN2CC3=CC=C(C=C3)F
Structure:
CAS RN: 112089-03-9
CAS Name: 9-[(4-chlorophenyl)methyl]-N,N-dimethyl-6-purinamine
OPENEYE Name: 9-[(4-chlorophenyl)methyl]-N,N-dimethyl-purin-6-amine
IUPAC Name: 9-[(4-chlorophenyl)methyl]-N,N-dimethylpurin-6-amine
SYSTEMATIC NAME: 9-[(4-chlorophenyl)methyl]-N,N-dimethyl-purin-6-amine
MOLECULAR FORMULA: C14H14ClN5
MOLECULAR WEIGHT: 287.74746
SMILES: CN(C)C1=NC=NC2=C1N=CN2CC3=CC=C(C=C3)Cl
Structure:
CAS RN: 115204-50-7
CAS Name: 9-[(3-aminophenyl)methyl]-N,N-dimethyl-6-purinamine
OPENEYE Name: 9-[(3-aminophenyl)methyl]-N,N-dimethyl-purin-6-amine
IUPAC Name: 9-[(3-aminophenyl)methyl]-N,N-dimethylpurin-6-amine
SYSTEMATIC NAME: 9-[(3-aminophenyl)methyl]-N,N-dimethyl-purin-6-amine
MOLECULAR FORMULA: C14H16N6
MOLECULAR WEIGHT: 268.31704
SMILES: CN(C)C1=NC=NC2=C1N=CN2CC3=CC(=CC=C3)N
Structure:
CAS RN: 115204-49-4
CAS Name: 2-amino-N-[3-[[6-(dimethylamino)-9-purinyl]methyl]phenyl]-3-phenylpropanamide
OPENEYE Name: 2-amino-N-[3-[[6-(dimethylamino)purin-9-yl]methyl]phenyl]-3-phenyl-propanamide
IUPAC Name: 2-amino-N-[3-[[6-(dimethylamino)purin-9-yl]methyl]phenyl]-3-phenylpropanamide
SYSTEMATIC NAME: 2-azanyl-N-[3-[[6-(dimethylamino)purin-9-yl]methyl]phenyl]-3-phenyl-propanamide
MOLECULAR FORMULA: C23H25N7O
MOLECULAR WEIGHT: 415.4909
SMILES: CN(C)C1=NC=NC2=C1N=CN2CC3=CC(=CC=C3)NC(=O)C(CC4=CC=CC=C4)N
Structure:
CAS RN: 37640-73-6
CAS Name: 3-(6-methoxy-1H-benzimidazol-2-yl)propanoic acid
OPENEYE Name: 3-(6-methoxy-1H-benzimidazol-2-yl)propanoic acid
IUPAC Name: 3-(6-methoxy-1H-benzimidazol-2-yl)propanoic acid
SYSTEMATIC NAME: 3-(6-methoxy-1H-benzimidazol-2-yl)propanoic acid
MOLECULAR FORMULA: C11H12N2O3
MOLECULAR WEIGHT: 220.22458
SMILES: COC1=CC2=C(C=C1)N=C(N2)CCC(=O)O
Structure:
CAS RN: 66304-01-6
CAS Name: 1,1-dioxo-1$l^{6},2-benzodithiol-3-one
OPENEYE Name: 1,1-dioxo-1$l^{6},2-benzodithiol-3-one
IUPAC Name: 1,1-dioxo-1$l^{6},2-benzodithiol-3-one
SYSTEMATIC NAME: 1,1-bis(oxidanylidene)-1$l^{6},2-benzodithiol-3-one
MOLECULAR FORMULA: C7H4O3S2
MOLECULAR WEIGHT: 200.23486
SMILES: C1=CC=C2C(=C1)C(=O)SS2(=O)=O
Structure:
CAS RN: 306296-47-9
CAS Name: (4,6-dimethyl-5-pyrimidinyl)-[4-[(3S)-4-[(1R)-2-methoxy-1-[4-(trifluoromethyl)phenyl]ethyl]-3-methyl-1-piperazinyl]-4-methyl-1-piperidinyl]methanone
OPENEYE Name: (4,6-dimethylpyrimidin-5-yl)-[4-[(3S)-4-[(1R)-2-methoxy-1-[4-(trifluoromethyl)phenyl]ethyl]-3-methyl-piperazin-1-yl]-4-methyl-1-piperidyl]methanone
IUPAC Name: (4,6-dimethylpyrimidin-5-yl)-[4-[(3S)-4-[(1R)-2-methoxy-1-[4-(trifluoromethyl)phenyl]ethyl]-3-methylpiperazin-1-yl]-4-methylpiperidin-1-yl]methanone
SYSTEMATIC NAME: (4,6-dimethylpyrimidin-5-yl)-[4-[(3S)-4-[(1R)-2-methoxy-1-[4-(trifluoromethyl)phenyl]ethyl]-3-methyl-piperazin-1-yl]-4-methyl-piperidin-1-yl]methanone
MOLECULAR FORMULA: C28H38F3N5O2
MOLECULAR WEIGHT: 533.62883
SMILES: C[C@H]1CN(CCN1[C@@H](COC)C2=CC=C(C=C2)C(F)(F)F)C3(CCN(CC3)C(=O)C4=C(N=CN=C4C)C)C
Structure:
CAS RN: 167826-38-2
CAS Name: N-[5-[(4R,5S,6S,7R)-5,6-dihydroxy-2-oxo-3-[5-[[oxo(pyridin-4-yl)methyl]amino]pentyl]-4,7-bis(phenylmethyl)-1,3-diazepan-1-yl]pentyl]-4-pyridinecarboxamide
OPENEYE Name: N-[5-[(4R,5S,6S,7R)-4,7-dibenzyl-5,6-dihydroxy-2-oxo-3-[5-(pyridine-4-carbonylamino)pentyl]-1,3-diazepan-1-yl]pentyl]pyridine-4-carboxamide
IUPAC Name: N-[5-[(4R,5S,6S,7R)-4,7-dibenzyl-5,6-dihydroxy-2-oxo-3-[5-(pyridine-4-carbonylamino)pentyl]-1,3-diazepan-1-yl]pentyl]pyridine-4-carboxamide
SYSTEMATIC NAME: N-[5-[(4R,5S,6S,7R)-5,6-bis(oxidanyl)-2-oxidanylidene-4,7-bis(phenylmethyl)-3-[5-(pyridin-4-ylcarbonylamino)pentyl]-1,3-diazepan-1-yl]pentyl]pyridine-4-carboxamide
MOLECULAR FORMULA: C41H50N6O5
MOLECULAR WEIGHT: 706.8729
SMILES: C1=CC=C(C=C1)C[C@@H]2[C@@H]([C@H]([C@H](N(C(=O)N2CCCCCNC(=O)C3=CC=NC=C3)CCCCCNC(=O)C4=CC=NC=C4)CC5=CC=CC=C5)O)O
Structure:
CAS RN: 192575-93-2
CAS Name: N-[5-[(4R,5S,6S,7R)-5,6-dihydroxy-2-oxo-3-[5-[[1-oxo-2-(3-pyridinyl)ethyl]amino]pentyl]-4,7-bis(phenylmethyl)-1,3-diazepan-1-yl]pentyl]-2-(3-pyridinyl)acetamide
OPENEYE Name: N-[5-[(4R,5S,6S,7R)-4,7-dibenzyl-5,6-dihydroxy-2-oxo-3-[5-[[2-(3-pyridyl)acetyl]amino]pentyl]-1,3-diazepan-1-yl]pentyl]-2-(3-pyridyl)acetamide
IUPAC Name: N-[5-[(4R,5S,6S,7R)-4,7-dibenzyl-5,6-dihydroxy-2-oxo-3-[5-[(2-pyridin-3-ylacetyl)amino]pentyl]-1,3-diazepan-1-yl]pentyl]-2-pyridin-3-ylacetamide
SYSTEMATIC NAME: N-[5-[(4R,5S,6S,7R)-5,6-bis(oxidanyl)-2-oxidanylidene-4,7-bis(phenylmethyl)-3-[5-(2-pyridin-3-ylethanoylamino)pentyl]-1,3-diazepan-1-yl]pentyl]-2-pyridin-3-yl-ethanamide
MOLECULAR FORMULA: C43H54N6O5
MOLECULAR WEIGHT: 734.92606
SMILES: C1=CC=C(C=C1)C[C@@H]2[C@@H]([C@H]([C@H](N(C(=O)N2CCCCCNC(=O)CC3=CN=CC=C3)CCCCCNC(=O)CC4=CN=CC=C4)CC5=CC=CC=C5)O)O
Structure:
CAS RN: 167824-49-9
CAS Name: (4R,5S,6S,7R)-5,6-dihydroxy-1-(5-hydroxypentyl)-3,4,7-tris(phenylmethyl)-1,3-diazepan-2-one
OPENEYE Name: (4R,5S,6S,7R)-1,4,7-tribenzyl-5,6-dihydroxy-3-(5-hydroxypentyl)-1,3-diazepan-2-one
IUPAC Name: (4R,5S,6S,7R)-1,4,7-tribenzyl-5,6-dihydroxy-3-(5-hydroxypentyl)-1,3-diazepan-2-one
SYSTEMATIC NAME: (4R,5S,6S,7R)-5,6-bis(oxidanyl)-1-(5-oxidanylpentyl)-3,4,7-tris(phenylmethyl)-1,3-diazepan-2-one
MOLECULAR FORMULA: C31H38N2O4
MOLECULAR WEIGHT: 502.64442
SMILES: C1=CC=C(C=C1)C[C@@H]2[C@@H]([C@H]([C@H](N(C(=O)N2CCCCCO)CC3=CC=CC=C3)CC4=CC=CC=C4)O)O
Structure:
CAS RN: 167824-61-5
CAS Name: (4R,5S,6S,7R)-1-(cyclopropylmethyl)-5,6-dihydroxy-3-(5-hydroxypentyl)-4,7-bis(phenylmethyl)-1,3-diazepan-2-one
OPENEYE Name: (4R,5S,6S,7R)-4,7-dibenzyl-1-(cyclopropylmethyl)-5,6-dihydroxy-3-(5-hydroxypentyl)-1,3-diazepan-2-one
IUPAC Name: (4R,5S,6S,7R)-4,7-dibenzyl-1-(cyclopropylmethyl)-5,6-dihydroxy-3-(5-hydroxypentyl)-1,3-diazepan-2-one
SYSTEMATIC NAME: (4R,5S,6S,7R)-1-(cyclopropylmethyl)-5,6-bis(oxidanyl)-3-(5-oxidanylpentyl)-4,7-bis(phenylmethyl)-1,3-diazepan-2-one
MOLECULAR FORMULA: C28H38N2O4
MOLECULAR WEIGHT: 466.61232
SMILES: C1CC1CN2[C@@H]([C@@H]([C@H]([C@H](N(C2=O)CCCCCO)CC3=CC=CC=C3)O)O)CC4=CC=CC=C4
Structure:
CAS RN: 167824-65-9
CAS Name: 3-[[(4R,5S,6S,7R)-5,6-dihydroxy-3-(5-hydroxypentyl)-2-oxo-4,7-bis(phenylmethyl)-1,3-diazepan-1-yl]methyl]benzoic acid ethyl ester
OPENEYE Name: ethyl 3-[[(4R,5S,6S,7R)-4,7-dibenzyl-5,6-dihydroxy-3-(5-hydroxypentyl)-2-oxo-1,3-diazepan-1-yl]methyl]benzoate
IUPAC Name: ethyl 3-[[(4R,5S,6S,7R)-4,7-dibenzyl-5,6-dihydroxy-3-(5-hydroxypentyl)-2-oxo-1,3-diazepan-1-yl]methyl]benzoate
SYSTEMATIC NAME: ethyl 3-[[(4R,5S,6S,7R)-5,6-bis(oxidanyl)-2-oxidanylidene-3-(5-oxidanylpentyl)-4,7-bis(phenylmethyl)-1,3-diazepan-1-yl]methyl]benzoate
MOLECULAR FORMULA: C34H42N2O6
MOLECULAR WEIGHT: 574.70708
SMILES: CCOC(=O)C1=CC(=CC=C1)CN2[C@@H]([C@@H]([C@H]([C@H](N(C2=O)CCCCCO)CC3=CC=CC=C3)O)O)CC4=CC=CC=C4
Structure:
CAS RN: 167824-58-0
CAS Name: (4R,5S,6S,7R)-5,6-dihydroxy-1-(5-hydroxypentyl)-3-[(3-hydroxyphenyl)methyl]-4,7-bis(phenylmethyl)-1,3-diazepan-2-one
OPENEYE Name: (4R,5S,6S,7R)-4,7-dibenzyl-5,6-dihydroxy-1-(5-hydroxypentyl)-3-[(3-hydroxyphenyl)methyl]-1,3-diazepan-2-one
IUPAC Name: (4R,5S,6S,7R)-4,7-dibenzyl-5,6-dihydroxy-1-(5-hydroxypentyl)-3-[(3-hydroxyphenyl)methyl]-1,3-diazepan-2-one
SYSTEMATIC NAME: (4R,5S,6S,7R)-1-[(3-hydroxyphenyl)methyl]-5,6-bis(oxidanyl)-3-(5-oxidanylpentyl)-4,7-bis(phenylmethyl)-1,3-diazepan-2-one
MOLECULAR FORMULA: C31H38N2O5
MOLECULAR WEIGHT: 518.64382
SMILES: C1=CC=C(C=C1)C[C@@H]2[C@@H]([C@H]([C@H](N(C(=O)N2CCCCCO)CC3=CC(=CC=C3)O)CC4=CC=CC=C4)O)O
Structure:
CAS RN: 167824-71-7
CAS Name: (4R,5S,6S,7R)-5,6-dihydroxy-1-[[3-(hydroxymethyl)phenyl]methyl]-3-(5-hydroxypentyl)-4,7-bis(phenylmethyl)-1,3-diazepan-2-one
OPENEYE Name: (4R,5S,6S,7R)-4,7-dibenzyl-5,6-dihydroxy-1-[[3-(hydroxymethyl)phenyl]methyl]-3-(5-hydroxypentyl)-1,3-diazepan-2-one
IUPAC Name: (4R,5S,6S,7R)-4,7-dibenzyl-5,6-dihydroxy-1-[[3-(hydroxymethyl)phenyl]methyl]-3-(5-hydroxypentyl)-1,3-diazepan-2-one
SYSTEMATIC NAME: (4R,5S,6S,7R)-1-[[3-(hydroxymethyl)phenyl]methyl]-5,6-bis(oxidanyl)-3-(5-oxidanylpentyl)-4,7-bis(phenylmethyl)-1,3-diazepan-2-one
MOLECULAR FORMULA: C32H40N2O5
MOLECULAR WEIGHT: 532.6704
SMILES: C1=CC=C(C=C1)C[C@@H]2[C@@H]([C@H]([C@H](N(C(=O)N2CCCCCO)CC3=CC(=CC=C3)CO)CC4=CC=CC=C4)O)O
Structure:
CAS RN: 167824-51-3
CAS Name: (4R,5S,6S,7R)-5,6-dihydroxy-1-[[4-(hydroxymethyl)phenyl]methyl]-3-(5-hydroxypentyl)-4,7-bis(phenylmethyl)-1,3-diazepan-2-one
OPENEYE Name: (4R,5S,6S,7R)-4,7-dibenzyl-5,6-dihydroxy-1-[[4-(hydroxymethyl)phenyl]methyl]-3-(5-hydroxypentyl)-1,3-diazepan-2-one
IUPAC Name: (4R,5S,6S,7R)-4,7-dibenzyl-5,6-dihydroxy-1-[[4-(hydroxymethyl)phenyl]methyl]-3-(5-hydroxypentyl)-1,3-diazepan-2-one
SYSTEMATIC NAME: (4R,5S,6S,7R)-1-[[4-(hydroxymethyl)phenyl]methyl]-5,6-bis(oxidanyl)-3-(5-oxidanylpentyl)-4,7-bis(phenylmethyl)-1,3-diazepan-2-one
MOLECULAR FORMULA: C32H40N2O5
MOLECULAR WEIGHT: 532.6704
SMILES: C1=CC=C(C=C1)C[C@@H]2[C@@H]([C@H]([C@H](N(C(=O)N2CCCCCO)CC3=CC=C(C=C3)CO)CC4=CC=CC=C4)O)O
Structure:
CAS RN: 167824-57-9
CAS Name: (4R,5S,6S,7R)-5,6-dihydroxy-1-(6-hydroxyhexyl)-3-(2-naphthalenylmethyl)-4,7-bis(phenylmethyl)-1,3-diazepan-2-one
OPENEYE Name: (4R,5S,6S,7R)-4,7-dibenzyl-5,6-dihydroxy-1-(6-hydroxyhexyl)-3-(2-naphthylmethyl)-1,3-diazepan-2-one
IUPAC Name: (4R,5S,6S,7R)-4,7-dibenzyl-5,6-dihydroxy-1-(6-hydroxyhexyl)-3-(naphthalen-2-ylmethyl)-1,3-diazepan-2-one
SYSTEMATIC NAME: (4R,5S,6S,7R)-1-(naphthalen-2-ylmethyl)-5,6-bis(oxidanyl)-3-(6-oxidanylhexyl)-4,7-bis(phenylmethyl)-1,3-diazepan-2-one
MOLECULAR FORMULA: C36H42N2O4
MOLECULAR WEIGHT: 566.72968
SMILES: C1=CC=C(C=C1)C[C@@H]2[C@@H]([C@H]([C@H](N(C(=O)N2CCCCCCO)CC3=CC4=CC=CC=C4C=C3)CC5=CC=CC=C5)O)O
Structure:
CAS RN: 167824-48-8
CAS Name: (4R,5S,6S,7R)-5,6-dihydroxy-1-(5-hydroxypentyl)-3-(2-naphthalenylmethyl)-4,7-bis(phenylmethyl)-1,3-diazepan-2-one
OPENEYE Name: (4R,5S,6S,7R)-4,7-dibenzyl-5,6-dihydroxy-1-(5-hydroxypentyl)-3-(2-naphthylmethyl)-1,3-diazepan-2-one
IUPAC Name: (4R,5S,6S,7R)-4,7-dibenzyl-5,6-dihydroxy-1-(5-hydroxypentyl)-3-(naphthalen-2-ylmethyl)-1,3-diazepan-2-one
SYSTEMATIC NAME: (4R,5S,6S,7R)-1-(naphthalen-2-ylmethyl)-5,6-bis(oxidanyl)-3-(5-oxidanylpentyl)-4,7-bis(phenylmethyl)-1,3-diazepan-2-one
MOLECULAR FORMULA: C35H40N2O4
MOLECULAR WEIGHT: 552.7031
SMILES: C1=CC=C(C=C1)C[C@@H]2[C@@H]([C@H]([C@H](N(C(=O)N2CCCCCO)CC3=CC4=CC=CC=C4C=C3)CC5=CC=CC=C5)O)O
Structure:
CAS RN: 167826-40-6
CAS Name: 4-fluoro-N-[5-[(4R,5S,6S,7R)-3-[5-[[(4-fluorophenyl)-oxomethyl]amino]pentyl]-5,6-dihydroxy-2-oxo-4,7-bis(phenylmethyl)-1,3-diazepan-1-yl]pentyl]benzamide
OPENEYE Name: N-[5-[(4R,5S,6S,7R)-4,7-dibenzyl-3-[5-[(4-fluorobenzoyl)amino]pentyl]-5,6-dihydroxy-2-oxo-1,3-diazepan-1-yl]pentyl]-4-fluoro-benzamide
IUPAC Name: N-[5-[(4R,5S,6S,7R)-4,7-dibenzyl-3-[5-[(4-fluorobenzoyl)amino]pentyl]-5,6-dihydroxy-2-oxo-1,3-diazepan-1-yl]pentyl]-4-fluorobenzamide
SYSTEMATIC NAME: 4-fluoranyl-N-[5-[(4R,5S,6S,7R)-3-[5-[(4-fluorophenyl)carbonylamino]pentyl]-5,6-bis(oxidanyl)-2-oxidanylidene-4,7-bis(phenylmethyl)-1,3-diazepan-1-yl]pentyl]benzamide
MOLECULAR FORMULA: C43H50F2N4O5
MOLECULAR WEIGHT: 740.877706
SMILES: C1=CC=C(C=C1)C[C@@H]2[C@@H]([C@H]([C@H](N(C(=O)N2CCCCCNC(=O)C3=CC=C(C=C3)F)CCCCCNC(=O)C4=CC=C(C=C4)F)CC5=CC=CC=C5)O)O
Structure:
CAS RN: 167826-36-0
CAS Name: 3-fluoro-N-[5-[(4R,5S,6S,7R)-3-[5-[[(3-fluorophenyl)-oxomethyl]amino]pentyl]-5,6-dihydroxy-2-oxo-4,7-bis(phenylmethyl)-1,3-diazepan-1-yl]pentyl]benzamide
OPENEYE Name: N-[5-[(4R,5S,6S,7R)-4,7-dibenzyl-3-[5-[(3-fluorobenzoyl)amino]pentyl]-5,6-dihydroxy-2-oxo-1,3-diazepan-1-yl]pentyl]-3-fluoro-benzamide
IUPAC Name: N-[5-[(4R,5S,6S,7R)-4,7-dibenzyl-3-[5-[(3-fluorobenzoyl)amino]pentyl]-5,6-dihydroxy-2-oxo-1,3-diazepan-1-yl]pentyl]-3-fluorobenzamide
SYSTEMATIC NAME: 3-fluoranyl-N-[5-[(4R,5S,6S,7R)-3-[5-[(3-fluorophenyl)carbonylamino]pentyl]-5,6-bis(oxidanyl)-2-oxidanylidene-4,7-bis(phenylmethyl)-1,3-diazepan-1-yl]pentyl]benzamide
MOLECULAR FORMULA: C43H50F2N4O5
MOLECULAR WEIGHT: 740.877706
SMILES: C1=CC=C(C=C1)C[C@@H]2[C@@H]([C@H]([C@H](N(C(=O)N2CCCCCNC(=O)C3=CC(=CC=C3)F)CCCCCNC(=O)C4=CC(=CC=C4)F)CC5=CC=CC=C5)O)O
Structure:
CAS RN: 167826-35-9
CAS Name: N-[5-[(4R,5S,6S,7R)-3-(5-benzamidopentyl)-5,6-dihydroxy-2-oxo-4,7-bis(phenylmethyl)-1,3-diazepan-1-yl]pentyl]benzamide
OPENEYE Name: N-[5-[(4R,5S,6S,7R)-3-(5-benzamidopentyl)-4,7-dibenzyl-5,6-dihydroxy-2-oxo-1,3-diazepan-1-yl]pentyl]benzamide
IUPAC Name: N-[5-[(4R,5S,6S,7R)-3-(5-benzamidopentyl)-4,7-dibenzyl-5,6-dihydroxy-2-oxo-1,3-diazepan-1-yl]pentyl]benzamide
SYSTEMATIC NAME: N-[5-[(4R,5S,6S,7R)-3-(5-benzamidopentyl)-5,6-bis(oxidanyl)-2-oxidanylidene-4,7-bis(phenylmethyl)-1,3-diazepan-1-yl]pentyl]benzamide
MOLECULAR FORMULA: C43H52N4O5
MOLECULAR WEIGHT: 704.89678
SMILES: C1=CC=C(C=C1)C[C@@H]2[C@@H]([C@H]([C@H](N(C(=O)N2CCCCCNC(=O)C3=CC=CC=C3)CCCCCNC(=O)C4=CC=CC=C4)CC5=CC=CC=C5)O)O
Structure:
No comments:
Post a Comment