Friday, April 27, 2012

http://ChemLookup.com Compounds




CAS RN: 6416-05-3
CAS Name: 2-(3,4-dimethyl-N-methylsulfonylanilino)-N-(3-pyridinylmethyl)acetamide
OPENEYE Name: 2-(3,4-dimethyl-N-methylsulfonyl-anilino)-N-(3-pyridylmethyl)acetamide
IUPAC Name: 2-(3,4-dimethyl-N-methylsulfonylanilino)-N-(pyridin-3-ylmethyl)acetamide
SYSTEMATIC NAME: 2-[(3,4-dimethylphenyl)-methylsulfonyl-amino]-N-(pyridin-3-ylmethyl)ethanamide
MOLECULAR FORMULA: C17H21N3O3S
MOLECULAR WEIGHT: 347.43194
SMILES: CC1=C(C=C(C=C1)N(CC(=O)NCC2=CN=CC=C2)S(=O)(=O)C)C
Structure:

CAS RN: 345-70-0
CAS Name: 6-phenyl-4-pyrimidinamine
OPENEYE Name: 6-phenylpyrimidin-4-amine
IUPAC Name: 6-phenylpyrimidin-4-amine
SYSTEMATIC NAME: 6-phenylpyrimidin-4-amine
MOLECULAR FORMULA: C10H9N3
MOLECULAR WEIGHT: 171.19856
SMILES: C1=CC=C(C=C1)C2=CC(=NC=N2)N
Structure:

CAS RN: 143328-90-9
CAS Name: 5-fluoro-2-phenyl-1H-pyrimidin-6-one
OPENEYE Name: 5-fluoro-2-phenyl-1H-pyrimidin-6-one
IUPAC Name: 5-fluoro-2-phenyl-1H-pyrimidin-6-one
SYSTEMATIC NAME: 5-fluoranyl-2-phenyl-1H-pyrimidin-6-one
MOLECULAR FORMULA: C10H7FN2O
MOLECULAR WEIGHT: 190.173783
SMILES: C1=CC=C(C=C1)C2=NC=C(C(=O)N2)F
Structure:

CAS RN: 3749-21-1
CAS Name: 4-bromo-2-oxidoisoquinolin-2-ium
OPENEYE Name: 4-bromo-2-oxido-isoquinolin-2-ium
IUPAC Name: 4-bromo-2-oxidoisoquinolin-2-ium
SYSTEMATIC NAME: 4-bromanyl-2-oxidanidyl-isoquinolin-2-ium
MOLECULAR FORMULA: C9H6BrNO
MOLECULAR WEIGHT: 224.05404
SMILES: C1=CC=C2C(=C1)C=[N+](C=C2Br)[O-]
Structure:

CAS RN: 4964-71-0
CAS Name: 5-bromoquinoline
OPENEYE Name: 5-bromoquinoline
IUPAC Name: 5-bromoquinoline
SYSTEMATIC NAME: 5-bromanylquinoline
MOLECULAR FORMULA: C9H6BrN
MOLECULAR WEIGHT: 208.05464
SMILES: C1=CC2=C(C=CC=N2)C(=C1)Br
Structure:

CAS RN: 1633-43-8
CAS Name: 4-ethoxy-3-pyridinamine
OPENEYE Name: 4-ethoxypyridin-3-amine
IUPAC Name: 4-ethoxypyridin-3-amine
SYSTEMATIC NAME: 4-ethoxypyridin-3-amine
MOLECULAR FORMULA: C7H10N2O
MOLECULAR WEIGHT: 138.1671
SMILES: CCOC1=C(C=NC=C1)N
Structure:

CAS RN: 55849-30-4
CAS Name: 5-bromo-2-ethoxypyridine
OPENEYE Name: 5-bromo-2-ethoxy-pyridine
IUPAC Name: 5-bromo-2-ethoxypyridine
SYSTEMATIC NAME: 5-bromanyl-2-ethoxy-pyridine
MOLECULAR FORMULA: C7H8BrNO
MOLECULAR WEIGHT: 202.04852
SMILES: CCOC1=NC=C(C=C1)Br
Structure:

CAS RN: 117846-58-9
CAS Name: 2,6-dibromo-3,5-dimethylpyridine
OPENEYE Name: 2,6-dibromo-3,5-dimethyl-pyridine
IUPAC Name: 2,6-dibromo-3,5-dimethylpyridine
SYSTEMATIC NAME: 2,6-bis(bromanyl)-3,5-dimethyl-pyridine
MOLECULAR FORMULA: C7H7Br2N
MOLECULAR WEIGHT: 264.94518
SMILES: CC1=CC(=C(N=C1Br)Br)C
Structure:

CAS RN: 7268-35-1
CAS Name: 5-amino-2-bromobenzonitrile
OPENEYE Name: 5-amino-2-bromo-benzonitrile
IUPAC Name: 5-amino-2-bromobenzonitrile
SYSTEMATIC NAME: 5-azanyl-2-bromanyl-benzenecarbonitrile
MOLECULAR FORMULA: C7H5BrN2
MOLECULAR WEIGHT: 197.032
SMILES: C1=CC(=C(C=C1N)C#N)Br
Structure:

CAS RN: 873383-11-0
CAS Name: 6-bromo-1-methyl-2-pyridinone
OPENEYE Name: 6-bromo-1-methyl-pyridin-2-one
IUPAC Name: 6-bromo-1-methylpyridin-2-one
SYSTEMATIC NAME: 6-bromanyl-1-methyl-pyridin-2-one
MOLECULAR FORMULA: C6H6BrNO
MOLECULAR WEIGHT: 188.02194
SMILES: CN1C(=O)C=CC=C1Br
Structure:

CAS RN: 50720-12-2
CAS Name: 3-bromo-5-methoxypyridine
OPENEYE Name: 3-bromo-5-methoxy-pyridine
IUPAC Name: 3-bromo-5-methoxypyridine
SYSTEMATIC NAME: 3-bromanyl-5-methoxy-pyridine
MOLECULAR FORMULA: C6H6BrNO
MOLECULAR WEIGHT: 188.02194
SMILES: COC1=CC(=CN=C1)Br
Structure:

CAS RN: 97483-77-7
CAS Name: 5-bromo-2-pyridinecarbonitrile
OPENEYE Name: 5-bromopyridine-2-carbonitrile
IUPAC Name: 5-bromopyridine-2-carbonitrile
SYSTEMATIC NAME: 5-bromanylpyridine-2-carbonitrile
MOLECULAR FORMULA: C6H3BrN2
MOLECULAR WEIGHT: 183.00542
SMILES: C1=CC(=NC=C1Br)C#N
Structure:

CAS RN: 20577-26-8
CAS Name: 2-bromo-3-pyridinecarbonitrile
OPENEYE Name: 2-bromopyridine-3-carbonitrile
IUPAC Name: 2-bromopyridine-3-carbonitrile
SYSTEMATIC NAME: 2-bromanylpyridine-3-carbonitrile
MOLECULAR FORMULA: C6H3BrN2
MOLECULAR WEIGHT: 183.00542
SMILES: C1=CC(=C(N=C1)Br)C#N
Structure:

CAS RN: 274-79-3
CAS Name: 3-methyl-1H-pyridazine-6-thione
OPENEYE Name: 3-methyl-1H-pyridazine-6-thione
IUPAC Name: 3-methyl-1H-pyridazine-6-thione
SYSTEMATIC NAME: 3-methyl-1H-pyridazine-6-thione
MOLECULAR FORMULA: C5H6N2S
MOLECULAR WEIGHT: 126.17954
SMILES: CC1=NNC(=S)C=C1
Structure:

CAS RN: 9030-21-1
CAS Name: 6-chloropyridine-3,4-diamine
OPENEYE Name: 6-chloropyridine-3,4-diamine
IUPAC Name: 6-chloropyridine-3,4-diamine
SYSTEMATIC NAME: 6-chloranylpyridine-3,4-diamine
MOLECULAR FORMULA: C5H6ClN3
MOLECULAR WEIGHT: 143.57424
SMILES: C1=C(C(=CN=C1Cl)N)N
Structure:

CAS RN: 2247-88-3
CAS Name: 3-fluoro-4-pyridinamine
OPENEYE Name: 3-fluoropyridin-4-amine
IUPAC Name: 3-fluoropyridin-4-amine
SYSTEMATIC NAME: 3-fluoranylpyridin-4-amine
MOLECULAR FORMULA: C5H5FN2
MOLECULAR WEIGHT: 112.105003
SMILES: C1=CN=CC(=C1N)F
Structure:

CAS RN: 36953-37-4
CAS Name: 4-bromo-1H-pyridin-2-one
OPENEYE Name: 4-bromo-1H-pyridin-2-one
IUPAC Name: 4-bromo-1H-pyridin-2-one
SYSTEMATIC NAME: 4-bromanyl-1H-pyridin-2-one
MOLECULAR FORMULA: C5H4BrNO
MOLECULAR WEIGHT: 173.99536
SMILES: C1=CNC(=O)C=C1Br
Structure:

CAS RN: 13534-90-2
CAS Name: 3,4-dibromopyridine
OPENEYE Name: 3,4-dibromopyridine
IUPAC Name: 3,4-dibromopyridine
SYSTEMATIC NAME: 3,4-bis(bromanyl)pyridine
MOLECULAR FORMULA: C5H3Br2N
MOLECULAR WEIGHT: 236.89202
SMILES: C1=CN=CC(=C1Br)Br
Structure:

CAS RN: 58530-53-3
CAS Name: 2,4-dibromopyridine
OPENEYE Name: 2,4-dibromopyridine
IUPAC Name: 2,4-dibromopyridine
SYSTEMATIC NAME: 2,4-bis(bromanyl)pyridine
MOLECULAR FORMULA: C5H3Br2N
MOLECULAR WEIGHT: 236.89202
SMILES: C1=CN=C(C=C1Br)Br
Structure:

CAS RN: 13534-89-9
CAS Name: 2,3-dibromopyridine
OPENEYE Name: 2,3-dibromopyridine
IUPAC Name: 2,3-dibromopyridine
SYSTEMATIC NAME: 2,3-bis(bromanyl)pyridine
MOLECULAR FORMULA: C5H3Br2N
MOLECULAR WEIGHT: 236.89202
SMILES: C1=CC(=C(N=C1)Br)Br
Structure:

CAS RN: 40473-01-6
CAS Name: 2-bromo-5-chloropyridine
OPENEYE Name: 2-bromo-5-chloro-pyridine
IUPAC Name: 2-bromo-5-chloropyridine
SYSTEMATIC NAME: 2-bromanyl-5-chloranyl-pyridine
MOLECULAR FORMULA: C5H3BrClN
MOLECULAR WEIGHT: 192.44102
SMILES: C1=CC(=NC=C1Cl)Br
Structure:

CAS RN: 90209-81-7
CAS Name: N-(2-aminophenyl)-2-pyridinecarboxamide
OPENEYE Name: N-(2-aminophenyl)pyridine-2-carboxamide
IUPAC Name: N-(2-aminophenyl)pyridine-2-carboxamide
SYSTEMATIC NAME: N-(2-aminophenyl)pyridine-2-carboxamide
MOLECULAR FORMULA: C12H11N3O
MOLECULAR WEIGHT: 213.23524
SMILES: C1=CC=C(C(=C1)N)NC(=O)C2=CC=CC=N2
Structure:

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