CAS RN: 607723-33-1
CAS Name: (5R)-5-[[4-[2-[[6-(4-methoxyphenoxy)-4-pyrimidinyl]-methylamino]ethoxy]phenyl]methyl]thiazolidine-2,4-dione
OPENEYE Name: (5R)-5-[[4-[2-[[6-(4-methoxyphenoxy)pyrimidin-4-yl]-methyl-amino]ethoxy]phenyl]methyl]thiazolidine-2,4-dione
IUPAC Name: (5R)-5-[[4-[2-[[6-(4-methoxyphenoxy)pyrimidin-4-yl]-methylamino]ethoxy]phenyl]methyl]-1,3-thiazolidine-2,4-dione
SYSTEMATIC NAME: (5R)-5-[[4-[2-[[6-(4-methoxyphenoxy)pyrimidin-4-yl]-methyl-amino]ethoxy]phenyl]methyl]-1,3-thiazolidine-2,4-dione
MOLECULAR FORMULA: C24H24N4O5S
MOLECULAR WEIGHT: 480.53616
SMILES: CN(CCOC1=CC=C(C=C1)C[C@@H]2C(=O)NC(=O)S2)C3=CC(=NC=N3)OC4=CC=C(C=C4)OC
Structure:
CAS RN: 845930-79-2
CAS Name: (1R)-1-(4-bromo-2-fluorophenyl)ethanamine
OPENEYE Name: (1R)-1-(4-bromo-2-fluoro-phenyl)ethanamine
IUPAC Name: (1R)-1-(4-bromo-2-fluorophenyl)ethanamine
SYSTEMATIC NAME: (1R)-1-(4-bromanyl-2-fluoranyl-phenyl)ethanamine
MOLECULAR FORMULA: C8H9BrFN
MOLECULAR WEIGHT: 218.066163
SMILES: C[C@H](C1=C(C=C(C=C1)Br)F)N
Structure:
CAS RN: 845829-94-9
CAS Name: 1-bromo-3-fluoro-2-methoxybenzene
OPENEYE Name: 1-bromo-3-fluoro-2-methoxy-benzene
IUPAC Name: 1-bromo-3-fluoro-2-methoxybenzene
SYSTEMATIC NAME: 1-bromanyl-3-fluoranyl-2-methoxy-benzene
MOLECULAR FORMULA: C7H6BrFO
MOLECULAR WEIGHT: 205.024343
SMILES: COC1=C(C=CC=C1Br)F
Structure:
CAS RN: 521300-03-8
CAS Name: 4-amino-5-propan-2-yl-1H-pyrazole-3-carboxamide
OPENEYE Name: 4-amino-5-isopropyl-1H-pyrazole-3-carboxamide
IUPAC Name: 4-amino-5-propan-2-yl-1H-pyrazole-3-carboxamide
SYSTEMATIC NAME: 4-azanyl-5-propan-2-yl-1H-pyrazole-3-carboxamide
MOLECULAR FORMULA: C7H12N4O
MOLECULAR WEIGHT: 168.19638
SMILES: CC(C)C1=C(C(=NN1)C(=O)N)N
Structure:
CAS RN: 26401-84-3
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C15H18O6
MOLECULAR WEIGHT: 294.29982
SMILES: CC(=C)[C@@H]1[C@H]2[C@H]([C@]3([C@@]4(CO4)[C@H]5[C@@H]([C@]3([C@@H]1C(=O)O2)O)O5)C)O
Structure:
CAS RN: 857876-30-3
CAS Name: N-(3,3-dimethyl-1,2-dihydroindol-6-yl)-2-(pyridin-4-ylmethylamino)-3-pyridinecarboxamide; phosphoric acid
OPENEYE Name: N-(3,3-dimethylindolin-6-yl)-2-(4-pyridylmethylamino)pyridine-3-carboxamide; phosphoric acid
IUPAC Name: N-(3,3-dimethyl-1,2-dihydroindol-6-yl)-2-(pyridin-4-ylmethylamino)pyridine-3-carboxamide; phosphoric acid
SYSTEMATIC NAME: N-(3,3-dimethyl-1,2-dihydroindol-6-yl)-2-(pyridin-4-ylmethylamino)pyridine-3-carboxamide; phosphoric acid
MOLECULAR FORMULA: C22H29N5O9P2
MOLECULAR WEIGHT: 569.441282
SMILES: CC1(CNC2=C1C=CC(=C2)NC(=O)C3=C(N=CC=C3)NCC4=CC=NC=C4)C.OP(=O)(O)O.OP(=O)(O)O
Structure:
CAS RN: 13967-66-3
CAS Name: iridium-191
OPENEYE Name: iridium-191
IUPAC Name: iridium-191
SYSTEMATIC NAME: iridium-191
MOLECULAR FORMULA: Ir
MOLECULAR WEIGHT: 190.960591
SMILES: [191Ir]
Structure:
CAS RN: 155309-06-1
CAS Name: 1-(2-isothiocyanato-5-bicyclo[2.2.1]heptanyl)ethanone
OPENEYE Name: 1-(5-isothiocyanatonorbornan-2-yl)ethanone
IUPAC Name: 1-(2-isothiocyanato-5-bicyclo[2.2.1]heptanyl)ethanone
SYSTEMATIC NAME: 1-(2-isothiocyanato-5-bicyclo[2.2.1]heptanyl)ethanone
MOLECULAR FORMULA: C10H13NOS
MOLECULAR WEIGHT: 195.28132
SMILES: CC(=O)C1CC2CC1CC2N=C=S
Structure:
CAS RN: 155418-07-8
CAS Name: 1-(3-isothiocyanato-5-bicyclo[2.2.1]heptanyl)ethanone
OPENEYE Name: 1-(6-isothiocyanatonorbornan-2-yl)ethanone
IUPAC Name: 1-(3-isothiocyanato-5-bicyclo[2.2.1]heptanyl)ethanone
SYSTEMATIC NAME: 1-(3-isothiocyanato-5-bicyclo[2.2.1]heptanyl)ethanone
MOLECULAR FORMULA: C10H13NOS
MOLECULAR WEIGHT: 195.28132
SMILES: CC(=O)C1CC2CC1C(C2)N=C=S
Structure:
CAS RN: 155418-08-9
CAS Name: 1-(3-isothiocyanato-5-bicyclo[2.2.1]heptanyl)ethanone
OPENEYE Name: 1-(6-isothiocyanatonorbornan-2-yl)ethanone
IUPAC Name: 1-(3-isothiocyanato-5-bicyclo[2.2.1]heptanyl)ethanone
SYSTEMATIC NAME: 1-(3-isothiocyanato-5-bicyclo[2.2.1]heptanyl)ethanone
MOLECULAR FORMULA: C10H13NOS
MOLECULAR WEIGHT: 195.28132
SMILES: CC(=O)C1CC2CC1C(C2)N=C=S
Structure:
CAS RN: 924663-37-6
CAS Name: 2-[[4-(3-methoxypropoxy)-3-methyl-1-oxido-2-pyridin-1-iumyl]methylsulfonyl]-1H-benzimidazole
OPENEYE Name: 2-[[4-(3-methoxypropoxy)-3-methyl-1-oxido-pyridin-1-ium-2-yl]methylsulfonyl]-1H-benzimidazole
IUPAC Name: 2-[[4-(3-methoxypropoxy)-3-methyl-1-oxidopyridin-1-ium-2-yl]methylsulfonyl]-1H-benzimidazole
SYSTEMATIC NAME: 2-[[4-(3-methoxypropoxy)-3-methyl-1-oxidanidyl-pyridin-1-ium-2-yl]methylsulfonyl]-1H-benzimidazole
MOLECULAR FORMULA: C18H21N3O5S
MOLECULAR WEIGHT: 391.44144
SMILES: CC1=C(C=C[N+](=C1CS(=O)(=O)C2=NC3=CC=CC=C3N2)[O-])OCCCOC
Structure:
CAS RN: 918659-56-0
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C22H18N4O4
MOLECULAR WEIGHT: 402.40272
SMILES: C[C@H]1C(=O)N2[C@@H]3N1C(=O)[C@@H](C[C@@]3(C4=CC=CC=C42)O)N5C=NC6=CC=CC=C6C5=O
Structure:
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