Friday, January 20, 2012

http://ChemLookup.com Compounds




CAS RN: 124066-44-0
CAS Name: 2-[[6-(4-chlorophenoxy)-4-pyrimidinyl]thio]acetic acid ethyl ester
OPENEYE Name: ethyl 2-[6-(4-chlorophenoxy)pyrimidin-4-yl]sulfanylacetate
IUPAC Name: ethyl 2-[6-(4-chlorophenoxy)pyrimidin-4-yl]sulfanylacetate
SYSTEMATIC NAME: ethyl 2-[6-(4-chloranylphenoxy)pyrimidin-4-yl]sulfanylethanoate
MOLECULAR FORMULA: C14H13ClN2O3S
MOLECULAR WEIGHT: 324.78262
SMILES: CCOC(=O)CSC1=NC=NC(=C1)OC2=CC=C(C=C2)Cl
Structure:

CAS RN: 124041-07-2
CAS Name: 2-[[6-(4-fluorophenoxy)-4-pyrimidinyl]thio]acetic acid ethyl ester
OPENEYE Name: ethyl 2-[6-(4-fluorophenoxy)pyrimidin-4-yl]sulfanylacetate
IUPAC Name: ethyl 2-[6-(4-fluorophenoxy)pyrimidin-4-yl]sulfanylacetate
SYSTEMATIC NAME: ethyl 2-[6-(4-fluoranylphenoxy)pyrimidin-4-yl]sulfanylethanoate
MOLECULAR FORMULA: C14H13FN2O3S
MOLECULAR WEIGHT: 308.328023
SMILES: CCOC(=O)CSC1=NC=NC(=C1)OC2=CC=C(C=C2)F
Structure:

CAS RN: 124041-06-1
CAS Name: 2-[(6-phenoxy-4-pyrimidinyl)thio]acetic acid ethyl ester
OPENEYE Name: ethyl 2-(6-phenoxypyrimidin-4-yl)sulfanylacetate
IUPAC Name: ethyl 2-(6-phenoxypyrimidin-4-yl)sulfanylacetate
SYSTEMATIC NAME: ethyl 2-(6-phenoxypyrimidin-4-yl)sulfanylethanoate
MOLECULAR FORMULA: C14H14N2O3S
MOLECULAR WEIGHT: 290.33756
SMILES: CCOC(=O)CSC1=NC=NC(=C1)OC2=CC=CC=C2
Structure:

CAS RN: 124041-05-0
CAS Name: 2-[[6-(4-methylphenoxy)-4-pyrimidinyl]thio]acetic acid ethyl ester
OPENEYE Name: ethyl 2-[6-(4-methylphenoxy)pyrimidin-4-yl]sulfanylacetate
IUPAC Name: ethyl 2-[6-(4-methylphenoxy)pyrimidin-4-yl]sulfanylacetate
SYSTEMATIC NAME: ethyl 2-[6-(4-methylphenoxy)pyrimidin-4-yl]sulfanylethanoate
MOLECULAR FORMULA: C15H16N2O3S
MOLECULAR WEIGHT: 304.36414
SMILES: CCOC(=O)CSC1=NC=NC(=C1)OC2=CC=C(C=C2)C
Structure:

CAS RN: 124041-02-7
CAS Name: 4-chloro-6-(4-chlorophenoxy)pyrimidine
OPENEYE Name: 4-chloro-6-(4-chlorophenoxy)pyrimidine
IUPAC Name: 4-chloro-6-(4-chlorophenoxy)pyrimidine
SYSTEMATIC NAME: 4-chloranyl-6-(4-chloranylphenoxy)pyrimidine
MOLECULAR FORMULA: C10H6Cl2N2O
MOLECULAR WEIGHT: 241.07344
SMILES: C1=CC(=CC=C1OC2=CC(=NC=N2)Cl)Cl
Structure:

CAS RN: 123947-03-5
CAS Name: N-[3-nitro-4-(2-pyridinylmethyl)phenyl]pentanamide
OPENEYE Name: N-[3-nitro-4-(2-pyridylmethyl)phenyl]pentanamide
IUPAC Name: N-[3-nitro-4-(pyridin-2-ylmethyl)phenyl]pentanamide
SYSTEMATIC NAME: N-[3-nitro-4-(pyridin-2-ylmethyl)phenyl]pentanamide
MOLECULAR FORMULA: C17H19N3O3
MOLECULAR WEIGHT: 313.35106
SMILES: CCCCC(=O)NC1=CC(=C(C=C1)CC2=CC=CC=N2)[N+](=O)[O-]
Structure:

CAS RN: 123941-02-6
CAS Name: 4-[[2-(2,6-dimethylanilino)-2-oxoethyl]amino]butanoic acid
OPENEYE Name: 4-[[2-(2,6-dimethylanilino)-2-oxo-ethyl]amino]butanoic acid
IUPAC Name: 4-[[2-(2,6-dimethylanilino)-2-oxoethyl]amino]butanoic acid
SYSTEMATIC NAME: 4-[[2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl]amino]butanoic acid
MOLECULAR FORMULA: C14H20N2O3
MOLECULAR WEIGHT: 264.3202
SMILES: CC1=C(C(=CC=C1)C)NC(=O)CNCCCC(=O)O
Structure:

CAS RN: 123930-58-5
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C33H45NO10
MOLECULAR WEIGHT: 615.7111
SMILES: CCN1C[C@@]2([C@@H](C[C@@H](C34[C@@H]2[C@H](C(C31)[C@@H]5[C@@H]6[C@@H]4C[C@]([C@@H]6OC(=O)C7=CC=C(C=C7)OC)([C@@H](C5=O)OC)O)OC)OC)O)COC
Structure:

CAS RN: 123886-71-5
CAS Name: 2-[4-[(3S,4S)-7-methoxy-2,2-dimethyl-3-phenyl-3,4-dihydro-2H-1-benzopyran-4-yl]phenoxy]ethanamine
OPENEYE Name: 2-[4-[(3S,4S)-7-methoxy-2,2-dimethyl-3-phenyl-chroman-4-yl]phenoxy]ethanamine
IUPAC Name: 2-[4-[(3S,4S)-7-methoxy-2,2-dimethyl-3-phenyl-3,4-dihydrochromen-4-yl]phenoxy]ethanamine
SYSTEMATIC NAME: 2-[4-[(3S,4S)-7-methoxy-2,2-dimethyl-3-phenyl-3,4-dihydrochromen-4-yl]phenoxy]ethanamine
MOLECULAR FORMULA: C26H29NO3
MOLECULAR WEIGHT: 403.51336
SMILES: CC1([C@@H]([C@H](C2=C(O1)C=C(C=C2)OC)C3=CC=C(C=C3)OCCN)C4=CC=CC=C4)C
Structure:

CAS RN: 123886-70-4
CAS Name: (3S,4S)-4-[4-(3-chloropropoxy)phenyl]-7-methoxy-2,2-dimethyl-3-phenyl-3,4-dihydro-2H-1-benzopyran
OPENEYE Name: (3S,4S)-4-[4-(3-chloropropoxy)phenyl]-7-methoxy-2,2-dimethyl-3-phenyl-chromane
IUPAC Name: (3S,4S)-4-[4-(3-chloropropoxy)phenyl]-7-methoxy-2,2-dimethyl-3-phenyl-3,4-dihydrochromene
SYSTEMATIC NAME: (3S,4S)-4-[4-(3-chloranylpropoxy)phenyl]-7-methoxy-2,2-dimethyl-3-phenyl-3,4-dihydrochromene
MOLECULAR FORMULA: C27H29ClO3
MOLECULAR WEIGHT: 436.97036
SMILES: CC1([C@@H]([C@H](C2=C(O1)C=C(C=C2)OC)C3=CC=C(C=C3)OCCCCl)C4=CC=CC=C4)C
Structure:

CAS RN: 123886-69-1
CAS Name: (3S,4S)-7-methoxy-2,2-dimethyl-3-phenyl-4-(4-prop-2-enoxyphenyl)-3,4-dihydro-2H-1-benzopyran
OPENEYE Name: (3S,4S)-4-(4-allyloxyphenyl)-7-methoxy-2,2-dimethyl-3-phenyl-chromane
IUPAC Name: (3S,4S)-7-methoxy-2,2-dimethyl-3-phenyl-4-(4-prop-2-enoxyphenyl)-3,4-dihydrochromene
SYSTEMATIC NAME: (3S,4S)-7-methoxy-2,2-dimethyl-3-phenyl-4-(4-prop-2-enoxyphenyl)-3,4-dihydrochromene
MOLECULAR FORMULA: C27H28O3
MOLECULAR WEIGHT: 400.50942
SMILES: CC1([C@@H]([C@H](C2=C(O1)C=C(C=C2)OC)C3=CC=C(C=C3)OCC=C)C4=CC=CC=C4)C
Structure:

CAS RN: 123886-68-0
CAS Name: (3S,4S)-4-[4-(2-bromoethoxy)phenyl]-7-methoxy-2,2-dimethyl-3-phenyl-3,4-dihydro-2H-1-benzopyran
OPENEYE Name: (3S,4S)-4-[4-(2-bromoethoxy)phenyl]-7-methoxy-2,2-dimethyl-3-phenyl-chromane
IUPAC Name: (3S,4S)-4-[4-(2-bromoethoxy)phenyl]-7-methoxy-2,2-dimethyl-3-phenyl-3,4-dihydrochromene
SYSTEMATIC NAME: (3S,4S)-4-[4-(2-bromoethyloxy)phenyl]-7-methoxy-2,2-dimethyl-3-phenyl-3,4-dihydrochromene
MOLECULAR FORMULA: C26H27BrO3
MOLECULAR WEIGHT: 467.39478
SMILES: CC1([C@@H]([C@H](C2=C(O1)C=C(C=C2)OC)C3=CC=C(C=C3)OCCBr)C4=CC=CC=C4)C
Structure:

CAS RN: 123886-67-9
CAS Name: 2-[4-[(3S,4S)-7-methoxy-2,2-dimethyl-3-phenyl-3,4-dihydro-2H-1-benzopyran-4-yl]phenoxy]ethanol
OPENEYE Name: 2-[4-[(3S,4S)-7-methoxy-2,2-dimethyl-3-phenyl-chroman-4-yl]phenoxy]ethanol
IUPAC Name: 2-[4-[(3S,4S)-7-methoxy-2,2-dimethyl-3-phenyl-3,4-dihydrochromen-4-yl]phenoxy]ethanol
SYSTEMATIC NAME: 2-[4-[(3S,4S)-7-methoxy-2,2-dimethyl-3-phenyl-3,4-dihydrochromen-4-yl]phenoxy]ethanol
MOLECULAR FORMULA: C26H28O4
MOLECULAR WEIGHT: 404.49812
SMILES: CC1([C@@H]([C@H](C2=C(O1)C=C(C=C2)OC)C3=CC=C(C=C3)OCCO)C4=CC=CC=C4)C
Structure:

CAS RN: 123886-65-7
CAS Name: 2-[4-(7-methoxy-2,2-dimethyl-3-phenyl-1-benzopyran-4-yl)phenoxy]ethanamine
OPENEYE Name: 2-[4-(7-methoxy-2,2-dimethyl-3-phenyl-chromen-4-yl)phenoxy]ethanamine
IUPAC Name: 2-[4-(7-methoxy-2,2-dimethyl-3-phenylchromen-4-yl)phenoxy]ethanamine
SYSTEMATIC NAME: 2-[4-(7-methoxy-2,2-dimethyl-3-phenyl-chromen-4-yl)phenoxy]ethanamine
MOLECULAR FORMULA: C26H27NO3
MOLECULAR WEIGHT: 401.49748
SMILES: CC1(C(=C(C2=C(O1)C=C(C=C2)OC)C3=CC=C(C=C3)OCCN)C4=CC=CC=C4)C
Structure:

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