Friday, August 26, 2011

http://ChemLookup.com Compounds




CAS RN: 42242-13-7
CAS Name: 3-isothiazolo[4,3-b]pyridinamine
OPENEYE Name: isothiazolo[4,3-b]pyridin-3-amine
IUPAC Name: [1,2]thiazolo[4,3-b]pyridin-3-amine
SYSTEMATIC NAME: [1,2]thiazolo[4,3-b]pyridin-3-amine
MOLECULAR FORMULA: C6H5N3S
MOLECULAR WEIGHT: 151.189
SMILES: C1=CC2=NSC(=C2N=C1)N
Structure:

CAS RN: 42242-08-0
CAS Name: 3-bromoisothiazolo[3,4-b]pyridine
OPENEYE Name: 3-bromoisothiazolo[3,4-b]pyridine
IUPAC Name: 3-bromo-[1,2]thiazolo[3,4-b]pyridine
SYSTEMATIC NAME: 3-bromanyl-[1,2]thiazolo[3,4-b]pyridine
MOLECULAR FORMULA: C6H3BrN2S
MOLECULAR WEIGHT: 215.07042
SMILES: C1=CC2=C(SN=C2N=C1)Br
Structure:

CAS RN: 42242-14-8
CAS Name: 3-bromoisothiazolo[4,3-b]pyridine
OPENEYE Name: 3-bromoisothiazolo[4,3-b]pyridine
IUPAC Name: 3-bromo-[1,2]thiazolo[4,3-b]pyridine
SYSTEMATIC NAME: 3-bromanyl-[1,2]thiazolo[4,3-b]pyridine
MOLECULAR FORMULA: C6H3BrN2S
MOLECULAR WEIGHT: 215.07042
SMILES: C1=CC2=NSC(=C2N=C1)Br
Structure:

CAS RN: 915402-11-8
CAS Name: 2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1-benzothiophene-5-carbonitrile
OPENEYE Name: 2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzothiophene-5-carbonitrile
IUPAC Name: 2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1-benzothiophene-5-carbonitrile
SYSTEMATIC NAME: 2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1-benzothiophene-5-carbonitrile
MOLECULAR FORMULA: C15H16BNO2S
MOLECULAR WEIGHT: 285.16904
SMILES: B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(S2)C=CC(=C3)C#N
Structure:

CAS RN: 885267-15-2
CAS Name: 3-(3-bromophenyl)-1-cyclobutanone
OPENEYE Name: 3-(3-bromophenyl)cyclobutanone
IUPAC Name: 3-(3-bromophenyl)cyclobutan-1-one
SYSTEMATIC NAME: 3-(3-bromophenyl)cyclobutan-1-one
MOLECULAR FORMULA: C10H9BrO
MOLECULAR WEIGHT: 225.08186
SMILES: C1C(CC1=O)C2=CC(=CC=C2)Br
Structure:

CAS RN: 817209-48-6
CAS Name: 4-chloro-8-methoxycinnoline
OPENEYE Name: 4-chloro-8-methoxy-cinnoline
IUPAC Name: 4-chloro-8-methoxycinnoline
SYSTEMATIC NAME: 4-chloranyl-8-methoxy-cinnoline
MOLECULAR FORMULA: C9H7ClN2O
MOLECULAR WEIGHT: 194.61768
SMILES: COC1=CC=CC2=C1N=NC=C2Cl
Structure:

CAS RN: 108281-78-3
CAS Name: 6-bromo-3-methyl-[1,2,4]triazolo[4,3-a]pyridine
OPENEYE Name: 6-bromo-3-methyl-[1,2,4]triazolo[4,3-a]pyridine
IUPAC Name: 6-bromo-3-methyl-[1,2,4]triazolo[4,3-a]pyridine
SYSTEMATIC NAME: 6-bromanyl-3-methyl-[1,2,4]triazolo[4,3-a]pyridine
MOLECULAR FORMULA: C7H6BrN3
MOLECULAR WEIGHT: 212.04664
SMILES: CC1=NN=C2N1C=C(C=C2)Br
Structure:

CAS RN: 20426-84-0
CAS Name: 5-methylene-3,4-dihydro-2H-1-benzoxepin
OPENEYE Name: 5-methylene-3,4-dihydro-2H-1-benzoxepine
IUPAC Name: 5-methylidene-3,4-dihydro-2H-1-benzoxepine
SYSTEMATIC NAME: 5-methylidene-3,4-dihydro-2H-1-benzoxepine
MOLECULAR FORMULA: C11H12O
MOLECULAR WEIGHT: 160.21238
SMILES: C=C1CCCOC2=CC=CC=C12
Structure:

CAS RN: 885267-03-8
CAS Name: N-(6-bromo-3-pyridinyl)cyclobutanecarboxamide
OPENEYE Name: N-(6-bromo-3-pyridyl)cyclobutanecarboxamide
IUPAC Name: N-(6-bromopyridin-3-yl)cyclobutanecarboxamide
SYSTEMATIC NAME: N-(6-bromanylpyridin-3-yl)cyclobutanecarboxamide
MOLECULAR FORMULA: C10H11BrN2O
MOLECULAR WEIGHT: 255.11114
SMILES: C1CC(C1)C(=O)NC2=CN=C(C=C2)Br
Structure:

CAS RN: 885267-10-7
CAS Name: 1-bromo-3-(4-fluorobutylthio)benzene
OPENEYE Name: 1-bromo-3-(4-fluorobutylsulfanyl)benzene
IUPAC Name: 1-bromo-3-(4-fluorobutylsulfanyl)benzene
SYSTEMATIC NAME: 1-bromanyl-3-(4-fluoranylbutylsulfanyl)benzene
MOLECULAR FORMULA: C10H12BrFS
MOLECULAR WEIGHT: 263.169683
SMILES: C1=CC(=CC(=C1)Br)SCCCCF
Structure:

CAS RN: 885267-09-4
CAS Name: 1-bromo-3-(3,3,3-trifluoropropylthio)benzene
OPENEYE Name: 1-bromo-3-(3,3,3-trifluoropropylsulfanyl)benzene
IUPAC Name: 1-bromo-3-(3,3,3-trifluoropropylsulfanyl)benzene
SYSTEMATIC NAME: 1-bromanyl-3-[3,3,3-tris(fluoranyl)propylsulfanyl]benzene
MOLECULAR FORMULA: C9H8BrF3S
MOLECULAR WEIGHT: 285.12403
SMILES: C1=CC(=CC(=C1)Br)SCCC(F)(F)F
Structure:

CAS RN: 885267-08-3
CAS Name: 1-bromo-3-(2,2-difluoroethylthio)benzene
OPENEYE Name: 1-bromo-3-(2,2-difluoroethylsulfanyl)benzene
IUPAC Name: 1-bromo-3-(2,2-difluoroethylsulfanyl)benzene
SYSTEMATIC NAME: 1-[2,2-bis(fluoranyl)ethylsulfanyl]-3-bromanyl-benzene
MOLECULAR FORMULA: C8H7BrF2S
MOLECULAR WEIGHT: 253.106986
SMILES: C1=CC(=CC(=C1)Br)SCC(F)F
Structure:

CAS RN: 885266-93-3
CAS Name: 2-bromo-1,4-bis(difluoromethoxy)benzene
OPENEYE Name: 2-bromo-1,4-bis(difluoromethoxy)benzene
IUPAC Name: 2-bromo-1,4-bis(difluoromethoxy)benzene
SYSTEMATIC NAME: 1,4-bis[bis(fluoranyl)methoxy]-2-bromanyl-benzene
MOLECULAR FORMULA: C8H5BrF4O2
MOLECULAR WEIGHT: 289.021713
SMILES: C1=CC(=C(C=C1OC(F)F)Br)OC(F)F
Structure:

CAS RN: 885267-05-0
CAS Name: 1-bromo-2-(cyclobutylthio)benzene
OPENEYE Name: 1-bromo-2-cyclobutylsulfanyl-benzene
IUPAC Name: 1-bromo-2-cyclobutylsulfanylbenzene
SYSTEMATIC NAME: 1-bromanyl-2-cyclobutylsulfanyl-benzene
MOLECULAR FORMULA: C10H11BrS
MOLECULAR WEIGHT: 243.16334
SMILES: C1CC(C1)SC2=CC=CC=C2Br
Structure:

CAS RN: 885267-06-1
CAS Name: N-[cyclopropyl(thiophen-2-yl)methyl]cyclobutanamine
OPENEYE Name: N-[cyclopropyl(2-thienyl)methyl]cyclobutanamine
IUPAC Name: N-[cyclopropyl(thiophen-2-yl)methyl]cyclobutanamine
SYSTEMATIC NAME: N-[cyclopropyl(thiophen-2-yl)methyl]cyclobutanamine
MOLECULAR FORMULA: C12H17NS
MOLECULAR WEIGHT: 207.33508
SMILES: C1CC(C1)NC(C2CC2)C3=CC=CS3
Structure:

CAS RN: 885266-87-5
CAS Name: 1-(3-bromophenyl)-3-cyclobutylthiourea
OPENEYE Name: 1-(3-bromophenyl)-3-cyclobutyl-thiourea
IUPAC Name: 1-(3-bromophenyl)-3-cyclobutylthiourea
SYSTEMATIC NAME: 1-(3-bromophenyl)-3-cyclobutyl-thiourea
MOLECULAR FORMULA: C11H13BrN2S
MOLECULAR WEIGHT: 285.20332
SMILES: C1CC(C1)NC(=S)NC2=CC(=CC=C2)Br
Structure:

CAS RN: 885266-89-7
CAS Name: 1-(5-bromo-2-pyridinyl)-3-cyclopropylthiourea
OPENEYE Name: 1-(5-bromo-2-pyridyl)-3-cyclopropyl-thiourea
IUPAC Name: 1-(5-bromopyridin-2-yl)-3-cyclopropylthiourea
SYSTEMATIC NAME: 1-(5-bromanylpyridin-2-yl)-3-cyclopropyl-thiourea
MOLECULAR FORMULA: C9H10BrN3S
MOLECULAR WEIGHT: 272.1648
SMILES: C1CC1NC(=S)NC2=NC=C(C=C2)Br
Structure:

CAS RN: 885267-00-5
CAS Name: 1-(1-azetidinyl)-2-bromoethanone
OPENEYE Name: 1-(azetidin-1-yl)-2-bromo-ethanone
IUPAC Name: 1-(azetidin-1-yl)-2-bromoethanone
SYSTEMATIC NAME: 1-(azetidin-1-yl)-2-bromanyl-ethanone
MOLECULAR FORMULA: C5H8BrNO
MOLECULAR WEIGHT: 178.02712
SMILES: C1CN(C1)C(=O)CBr
Structure:

CAS RN: 112257-14-4
CAS Name: 4-(2-bromo-1-oxoethyl)-1,4-diazepane-1-carboxylic acid tert-butyl ester
OPENEYE Name: tert-butyl 4-(2-bromoacetyl)-1,4-diazepane-1-carboxylate
IUPAC Name: tert-butyl 4-(2-bromoacetyl)-1,4-diazepane-1-carboxylate
SYSTEMATIC NAME: tert-butyl 4-(2-bromanylethanoyl)-1,4-diazepane-1-carboxylate
MOLECULAR FORMULA: C12H21BrN2O3
MOLECULAR WEIGHT: 321.21074
SMILES: CC(C)(C)OC(=O)N1CCCN(CC1)C(=O)CBr
Structure:

CAS RN: 885267-04-9
CAS Name: (E)-3-(3-bromophenyl)-1-cyclobutyl-2-propen-1-one
OPENEYE Name: (E)-3-(3-bromophenyl)-1-cyclobutyl-prop-2-en-1-one
IUPAC Name: (E)-3-(3-bromophenyl)-1-cyclobutylprop-2-en-1-one
SYSTEMATIC NAME: (E)-3-(3-bromophenyl)-1-cyclobutyl-prop-2-en-1-one
MOLECULAR FORMULA: C13H13BrO
MOLECULAR WEIGHT: 265.14572
SMILES: C1CC(C1)C(=O)/C=C/C2=CC(=CC=C2)Br
Structure:

CAS RN: 885266-92-2
CAS Name: 4-(cyclobutylmethyl)-1,4-diazepane-1-carboxylic acid tert-butyl ester
OPENEYE Name: tert-butyl 4-(cyclobutylmethyl)-1,4-diazepane-1-carboxylate
IUPAC Name: tert-butyl 4-(cyclobutylmethyl)-1,4-diazepane-1-carboxylate
SYSTEMATIC NAME: tert-butyl 4-(cyclobutylmethyl)-1,4-diazepane-1-carboxylate
MOLECULAR FORMULA: C15H28N2O2
MOLECULAR WEIGHT: 268.39502
SMILES: CC(C)(C)OC(=O)N1CCCN(CC1)CC2CCC2
Structure:

CAS RN: 885267-02-7
CAS Name: 1-bromo-4-(2,2,3,3-tetrafluorocyclobutyl)benzene
OPENEYE Name: 1-bromo-4-(2,2,3,3-tetrafluorocyclobutyl)benzene
IUPAC Name: 1-bromo-4-(2,2,3,3-tetrafluorocyclobutyl)benzene
SYSTEMATIC NAME: 1-bromanyl-4-[2,2,3,3-tetrakis(fluoranyl)cyclobutyl]benzene
MOLECULAR FORMULA: C10H7BrF4
MOLECULAR WEIGHT: 283.060193
SMILES: C1C(C(C1(F)F)(F)F)C2=CC=C(C=C2)Br
Structure:

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