Tuesday, August 2, 2011

http://ChemLookup.com Compounds




CAS RN: 7153-64-2
CAS Name: 2-(1-pyridin-1-iumyl)-1-(1,2,3,4-tetrahydrophenanthren-9-yl)ethanone bromide
OPENEYE Name: 2-pyridin-1-ium-1-yl-1-(1,2,3,4-tetrahydrophenanthren-9-yl)ethanone bromide
IUPAC Name: 2-pyridin-1-ium-1-yl-1-(1,2,3,4-tetrahydrophenanthren-9-yl)ethanone bromide
SYSTEMATIC NAME: 2-pyridin-1-ium-1-yl-1-(1,2,3,4-tetrahydrophenanthren-9-yl)ethanone bromide
MOLECULAR FORMULA: C21H20BrNO
MOLECULAR WEIGHT: 382.2936
SMILES: C1CCC2=C(C1)C=C(C3=CC=CC=C23)C(=O)C[N+]4=CC=CC=C4.[Br-]
Structure:

CAS RN: 6299-38-3
CAS Name: 6-amino-3-[[4-[4-[2-(7-amino-1-oxo-3-sulfo-2-naphthalenylidene)hydrazinyl]-3-ethoxyphenyl]phenyl]hydrazinylidene]-4-oxo-2-naphthalenesulfonic acid; sodium
OPENEYE Name: 6-amino-3-[[4-[4-[2-(7-amino-1-oxo-3-sulfo-2-naphthylidene)hydrazino]-3-ethoxy-phenyl]phenyl]hydrazono]-4-oxo-naphthalene-2-sulfonic acid; sodium
IUPAC Name: 6-amino-3-[[4-[4-[2-(7-amino-1-oxo-3-sulfonaphthalen-2-ylidene)hydrazinyl]-3-ethoxyphenyl]phenyl]hydrazinylidene]-4-oxonaphthalene-2-sulfonic acid; sodium
SYSTEMATIC NAME: 6-azanyl-3-[[4-[4-[2-(7-azanyl-1-oxidanylidene-3-sulfo-naphthalen-2-ylidene)hydrazinyl]-3-ethoxy-phenyl]phenyl]hydrazinylidene]-4-oxidanylidene-naphthalene-2-sulfonic acid; sodium
MOLECULAR FORMULA: C34H28N6NaO9S2
MOLECULAR WEIGHT: 751.74069
SMILES: CCOC1=C(C=CC(=C1)C2=CC=C(C=C2)NN=C3C(=CC4=C(C3=O)C=C(C=C4)N)S(=O)(=O)O)NN=C5C(=CC6=C(C5=O)C=C(C=C6)N)S(=O)(=O)O.[Na]
Structure:

CAS RN: 6328-12-7
CAS Name: 1-(9-bromo-3-phenanthrenyl)-2-(didecylamino)ethanol chloride
OPENEYE Name: 1-(9-bromo-3-phenanthryl)-2-(didecylamino)ethanol chloride
IUPAC Name: 1-(9-bromophenanthren-3-yl)-2-(didecylamino)ethanol chloride
SYSTEMATIC NAME: 1-(9-bromanylphenanthren-3-yl)-2-(didecylamino)ethanol chloride
MOLECULAR FORMULA: C36H54BrClNO-
MOLECULAR WEIGHT: 632.17706
SMILES: CCCCCCCCCCN(CCCCCCCCCC)CC(C1=CC2=C(C=C1)C=C(C3=CC=CC=C32)Br)O.[Cl-]
Structure:

CAS RN: 6328-11-6
CAS Name: 1-(9-bromo-3-phenanthrenyl)-2-(dihexylamino)-1-propanone chloride
OPENEYE Name: 1-(9-bromo-3-phenanthryl)-2-(dihexylamino)propan-1-one chloride
IUPAC Name: 1-(9-bromophenanthren-3-yl)-2-(dihexylamino)propan-1-one chloride
SYSTEMATIC NAME: 1-(9-bromanylphenanthren-3-yl)-2-(dihexylamino)propan-1-one chloride
MOLECULAR FORMULA: C29H38BrClNO-
MOLECULAR WEIGHT: 531.97512
SMILES: CCCCCCN(CCCCCC)C(C)C(=O)C1=CC2=C(C=C1)C=C(C3=CC=CC=C32)Br.[Cl-]
Structure:

CAS RN: 54763-94-9
CAS Name: 1-[7-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)heptyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline hydrochloride
OPENEYE Name: 1-[7-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)heptyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline hydrochloride
IUPAC Name: 1-[7-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)heptyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline hydrochloride
SYSTEMATIC NAME: 1-[7-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)heptyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline hydrochloride
MOLECULAR FORMULA: C29H43ClN2O4
MOLECULAR WEIGHT: 519.11572
SMILES: COC1=C(C=C2C(NCCC2=C1)CCCCCCCC3C4=CC(=C(C=C4CCN3)OC)OC)OC.Cl
Structure:

CAS RN: 4460-60-0
CAS Name: 6-(aminomethyl)oxane-2,3,4,5-tetrol chloride
OPENEYE Name: 6-(aminomethyl)tetrahydropyran-2,3,4,5-tetrol chloride
IUPAC Name: 6-(aminomethyl)oxane-2,3,4,5-tetrol chloride
SYSTEMATIC NAME: 6-(aminomethyl)oxane-2,3,4,5-tetrol chloride
MOLECULAR FORMULA: C6H13ClNO5-
MOLECULAR WEIGHT: 214.62412
SMILES: C(C1C(C(C(C(O1)O)O)O)O)N.[Cl-]
Structure:

CAS RN: 40716-92-5
CAS Name: (2S,3R)-1,4-bis(2-bromoethylamino)butane-2,3-diol hydrobromide
OPENEYE Name: (2S,3R)-1,4-bis(2-bromoethylamino)butane-2,3-diol hydrobromide
IUPAC Name: (2S,3R)-1,4-bis(2-bromoethylamino)butane-2,3-diol hydrobromide
SYSTEMATIC NAME: (2S,3R)-1,4-bis(2-bromoethylamino)butane-2,3-diol hydrobromide
MOLECULAR FORMULA: C8H19Br3N2O2
MOLECULAR WEIGHT: 414.96066
SMILES: C(CBr)NC[C@H]([C@H](CNCCBr)O)O.Br
Structure:

CAS RN: 6345-50-2
CAS Name: 2-[(dimethylamino)methyl]-4-methyl-1-cyclohexanone chloride
OPENEYE Name: 2-[(dimethylamino)methyl]-4-methyl-cyclohexanone chloride
IUPAC Name: 2-[(dimethylamino)methyl]-4-methylcyclohexan-1-one chloride
SYSTEMATIC NAME: 2-[(dimethylamino)methyl]-4-methyl-cyclohexan-1-one chloride
MOLECULAR FORMULA: C10H19ClNO-
MOLECULAR WEIGHT: 204.71696
SMILES: CC1CCC(=O)C(C1)CN(C)C.[Cl-]
Structure:

CAS RN: 6345-48-8
CAS Name: 2-(octadecylthio)-1H-benzimidazole bromide
OPENEYE Name: 2-octadecylsulfanyl-1H-benzimidazole bromide
IUPAC Name: 2-octadecylsulfanyl-1H-benzimidazole bromide
SYSTEMATIC NAME: 2-octadecylsulfanyl-1H-benzimidazole bromide
MOLECULAR FORMULA: C25H42BrN2S-
MOLECULAR WEIGHT: 482.58338
SMILES: CCCCCCCCCCCCCCCCCCSC1=NC2=CC=CC=C2N1.[Br-]
Structure:

CAS RN: 6345-47-7
CAS Name: 2-(hexadecylthio)-1H-benzimidazole bromide
OPENEYE Name: 2-hexadecylsulfanyl-1H-benzimidazole bromide
IUPAC Name: 2-hexadecylsulfanyl-1H-benzimidazole bromide
SYSTEMATIC NAME: 2-hexadecylsulfanyl-1H-benzimidazole bromide
MOLECULAR FORMULA: C23H38BrN2S-
MOLECULAR WEIGHT: 454.53022
SMILES: CCCCCCCCCCCCCCCCSC1=NC2=CC=CC=C2N1.[Br-]
Structure:

CAS RN: 6345-46-6
CAS Name: 2-(tetradecylthio)-1H-benzimidazole bromide
OPENEYE Name: 2-tetradecylsulfanyl-1H-benzimidazole bromide
IUPAC Name: 2-tetradecylsulfanyl-1H-benzimidazole bromide
SYSTEMATIC NAME: 2-tetradecylsulfanyl-1H-benzimidazole bromide
MOLECULAR FORMULA: C21H34BrN2S-
MOLECULAR WEIGHT: 426.47706
SMILES: CCCCCCCCCCCCCCSC1=NC2=CC=CC=C2N1.[Br-]
Structure:

CAS RN: 6345-45-5
CAS Name: 2-(tridecylthio)-1H-benzimidazole bromide
OPENEYE Name: 2-tridecylsulfanyl-1H-benzimidazole bromide
IUPAC Name: 2-tridecylsulfanyl-1H-benzimidazole bromide
SYSTEMATIC NAME: 2-tridecylsulfanyl-1H-benzimidazole bromide
MOLECULAR FORMULA: C20H32BrN2S-
MOLECULAR WEIGHT: 412.45048
SMILES: CCCCCCCCCCCCCSC1=NC2=CC=CC=C2N1.[Br-]
Structure:

CAS RN: 6345-44-4
CAS Name: 2-(methoxymethylthio)-1,4,5,6-tetrahydropyrimidine chloride
OPENEYE Name: 2-(methoxymethylsulfanyl)-1,4,5,6-tetrahydropyrimidine chloride
IUPAC Name: 2-(methoxymethylsulfanyl)-1,4,5,6-tetrahydropyrimidine chloride
SYSTEMATIC NAME: 2-(methoxymethylsulfanyl)-1,4,5,6-tetrahydropyrimidine chloride
MOLECULAR FORMULA: C6H12ClN2OS-
MOLECULAR WEIGHT: 195.69028
SMILES: COCSC1=NCCCN1.[Cl-]
Structure:

CAS RN: 6345-39-7
CAS Name: N-[2-(carbamimidoylthio)ethyl]carbamic acid decyl ester hydroiodide
OPENEYE Name: decyl N-(2-carbamimidoylsulfanylethyl)carbamate hydroiodide
IUPAC Name: decyl N-(2-carbamimidoylsulfanylethyl)carbamate hydroiodide
SYSTEMATIC NAME: decyl N-(2-carbamimidoylsulfanylethyl)carbamate hydroiodide
MOLECULAR FORMULA: C14H30IN3O2S
MOLECULAR WEIGHT: 431.37637
SMILES: CCCCCCCCCCOC(=O)NCCSC(=N)N.I
Structure:

CAS RN: 6345-38-6
CAS Name: N-[2-(carbamimidoylthio)ethyl]carbamic acid octyl ester hydroiodide
OPENEYE Name: octyl N-(2-carbamimidoylsulfanylethyl)carbamate hydroiodide
IUPAC Name: octyl N-(2-carbamimidoylsulfanylethyl)carbamate hydroiodide
SYSTEMATIC NAME: octyl N-(2-carbamimidoylsulfanylethyl)carbamate hydroiodide
MOLECULAR FORMULA: C12H26IN3O2S
MOLECULAR WEIGHT: 403.32321
SMILES: CCCCCCCCOC(=O)NCCSC(=N)N.I
Structure:

CAS RN: 7252-47-3
CAS Name: N-[2-(carbamimidoylthio)ethyl]carbamic acid pentyl ester hydroiodide
OPENEYE Name: pentyl N-(2-carbamimidoylsulfanylethyl)carbamate hydroiodide
IUPAC Name: pentyl N-(2-carbamimidoylsulfanylethyl)carbamate hydroiodide
SYSTEMATIC NAME: pentyl N-(2-carbamimidoylsulfanylethyl)carbamate hydroiodide
MOLECULAR FORMULA: C9H20IN3O2S
MOLECULAR WEIGHT: 361.24347
SMILES: CCCCCOC(=O)NCCSC(=N)N.I
Structure:

CAS RN: 6345-35-3
CAS Name: N-[2-(carbamimidoylthio)ethyl]carbamic acid butyl ester hydroiodide
OPENEYE Name: butyl N-(2-carbamimidoylsulfanylethyl)carbamate hydroiodide
IUPAC Name: butyl N-(2-carbamimidoylsulfanylethyl)carbamate hydroiodide
SYSTEMATIC NAME: butyl N-(2-carbamimidoylsulfanylethyl)carbamate hydroiodide
MOLECULAR FORMULA: C8H18IN3O2S
MOLECULAR WEIGHT: 347.21689
SMILES: CCCCOC(=O)NCCSC(=N)N.I
Structure:

CAS RN: 6345-34-2
CAS Name: N-[2-(carbamimidoylthio)ethyl]carbamic acid propyl ester hydroiodide
OPENEYE Name: propyl N-(2-carbamimidoylsulfanylethyl)carbamate hydroiodide
IUPAC Name: propyl N-(2-carbamimidoylsulfanylethyl)carbamate hydroiodide
SYSTEMATIC NAME: propyl N-(2-carbamimidoylsulfanylethyl)carbamate hydroiodide
MOLECULAR FORMULA: C7H16IN3O2S
MOLECULAR WEIGHT: 333.19031
SMILES: CCCOC(=O)NCCSC(=N)N.I
Structure:

CAS RN: 6345-32-0
CAS Name: N-[2-(carbamimidoylthio)ethyl]carbamic acid ethyl ester hydroiodide
OPENEYE Name: ethyl N-(2-carbamimidoylsulfanylethyl)carbamate hydroiodide
IUPAC Name: ethyl N-(2-carbamimidoylsulfanylethyl)carbamate hydroiodide
SYSTEMATIC NAME: ethyl N-(2-carbamimidoylsulfanylethyl)carbamate hydroiodide
MOLECULAR FORMULA: C6H14IN3O2S
MOLECULAR WEIGHT: 319.16373
SMILES: CCOC(=O)NCCSC(=N)N.I
Structure:

CAS RN: 6345-31-9
CAS Name: N-[2-(carbamimidoylthio)ethyl]carbamic acid methyl ester hydroiodide
OPENEYE Name: methyl N-(2-carbamimidoylsulfanylethyl)carbamate hydroiodide
IUPAC Name: methyl N-(2-carbamimidoylsulfanylethyl)carbamate hydroiodide
SYSTEMATIC NAME: methyl N-(2-carbamimidoylsulfanylethyl)carbamate hydroiodide
MOLECULAR FORMULA: C5H12IN3O2S
MOLECULAR WEIGHT: 305.13715
SMILES: COC(=O)NCCSC(=N)N.I
Structure:

CAS RN: 6345-28-4
CAS Name: 2-(3-pyridinylamino)acetic acid chloride
OPENEYE Name: 2-(3-pyridylamino)acetic acid chloride
IUPAC Name: 2-(pyridin-3-ylamino)acetic acid chloride
SYSTEMATIC NAME: 2-(pyridin-3-ylamino)ethanoic acid chloride
MOLECULAR FORMULA: C7H8ClN2O2-
MOLECULAR WEIGHT: 187.60362
SMILES: C1=CC(=CN=C1)NCC(=O)O.[Cl-]
Structure:

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