Tuesday, October 11, 2011

http://ChemLookup.com Compounds




CAS RN: 50823-54-6
CAS Name: [(Z)-(2,3,4-trimethoxy-5,7,8,9-tetrahydrobenzo[7]annulen-6-ylidene)amino]thiourea
OPENEYE Name: [(Z)-(2,3,4-trimethoxy-5,7,8,9-tetrahydrobenzo[7]annulen-6-ylidene)amino]thiourea
IUPAC Name: [(Z)-(2,3,4-trimethoxy-5,7,8,9-tetrahydrobenzo[7]annulen-6-ylidene)amino]thiourea
SYSTEMATIC NAME: 1-[(Z)-(2,3,4-trimethoxy-5,7,8,9-tetrahydrobenzo[7]annulen-6-ylidene)amino]thiourea
MOLECULAR FORMULA: C15H21N3O3S
MOLECULAR WEIGHT: 323.41054
SMILES: COC1=C(C(=C2C/C(=N\NC(=S)N)/CCCC2=C1)OC)OC
Structure:

CAS RN: 50823-51-3
CAS Name: 4-hydroxy-2,3-dimethoxy-5,7,8,9-tetrahydrobenzo[7]annulen-6-one oxime
OPENEYE Name: 4-hydroxy-2,3-dimethoxy-5,7,8,9-tetrahydrobenzo[7]annulen-6-one oxime
IUPAC Name: (6Z)-6-hydroxyimino-2,3-dimethoxy-5,7,8,9-tetrahydrobenzo[7]annulen-4-ol
SYSTEMATIC NAME: (6Z)-6-hydroxyimino-2,3-dimethoxy-5,7,8,9-tetrahydrobenzo[7]annulen-4-ol
MOLECULAR FORMULA: C13H17NO4
MOLECULAR WEIGHT: 251.27838
SMILES: COC1=C(C(=C2C/C(=N\O)/CCCC2=C1)O)OC
Structure:

CAS RN: 50823-50-2
CAS Name: [(Z)-(4-hydroxy-2,3-dimethoxy-5,7,8,9-tetrahydrobenzo[7]annulen-6-ylidene)amino]thiourea
OPENEYE Name: [(Z)-(4-hydroxy-2,3-dimethoxy-5,7,8,9-tetrahydrobenzo[7]annulen-6-ylidene)amino]thiourea
IUPAC Name: [(Z)-(4-hydroxy-2,3-dimethoxy-5,7,8,9-tetrahydrobenzo[7]annulen-6-ylidene)amino]thiourea
SYSTEMATIC NAME: 1-[(Z)-(2,3-dimethoxy-4-oxidanyl-5,7,8,9-tetrahydrobenzo[7]annulen-6-ylidene)amino]thiourea
MOLECULAR FORMULA: C14H19N3O3S
MOLECULAR WEIGHT: 309.38396
SMILES: COC1=C(C(=C2C/C(=N\NC(=S)N)/CCCC2=C1)O)OC
Structure:

CAS RN: 50529-09-4
CAS Name: (3Z)-1-(2,6-dimethoxyphenyl)-3-(1-methyl-2-pyrrolidinylidene)urea
OPENEYE Name: (3Z)-1-(2,6-dimethoxyphenyl)-3-(1-methylpyrrolidin-2-ylidene)urea
IUPAC Name: (3Z)-1-(2,6-dimethoxyphenyl)-3-(1-methylpyrrolidin-2-ylidene)urea
SYSTEMATIC NAME: (3Z)-1-(2,6-dimethoxyphenyl)-3-(1-methylpyrrolidin-2-ylidene)urea
MOLECULAR FORMULA: C14H19N3O3
MOLECULAR WEIGHT: 277.31896
SMILES: CN\1CCC/C1=N/C(=O)NC2=C(C=CC=C2OC)OC
Structure:

CAS RN: 50529-07-2
CAS Name: (3Z)-1-(2,6-diethylphenyl)-3-(1-methyl-2-pyrrolidinylidene)urea
OPENEYE Name: (3Z)-1-(2,6-diethylphenyl)-3-(1-methylpyrrolidin-2-ylidene)urea
IUPAC Name: (3Z)-1-(2,6-diethylphenyl)-3-(1-methylpyrrolidin-2-ylidene)urea
SYSTEMATIC NAME: (3Z)-1-(2,6-diethylphenyl)-3-(1-methylpyrrolidin-2-ylidene)urea
MOLECULAR FORMULA: C16H23N3O
MOLECULAR WEIGHT: 273.37332
SMILES: CCC1=C(C(=CC=C1)CC)NC(=O)/N=C\2/CCCN2C
Structure:

CAS RN: 50529-04-9
CAS Name: (3Z)-1-(2,6-dichlorophenyl)-3-(1-methyl-2-pyrrolidinylidene)urea
OPENEYE Name: (3Z)-1-(2,6-dichlorophenyl)-3-(1-methylpyrrolidin-2-ylidene)urea
IUPAC Name: (3Z)-1-(2,6-dichlorophenyl)-3-(1-methylpyrrolidin-2-ylidene)urea
SYSTEMATIC NAME: (3Z)-1-[2,6-bis(chloranyl)phenyl]-3-(1-methylpyrrolidin-2-ylidene)urea
MOLECULAR FORMULA: C12H13Cl2N3O
MOLECULAR WEIGHT: 286.15712
SMILES: CN\1CCC/C1=N/C(=O)NC2=C(C=CC=C2Cl)Cl
Structure:

CAS RN: 50528-56-8
CAS Name: (3Z)-1-(2-ethyl-6-methylphenyl)-3-(1-methyl-2-pyrrolidinylidene)urea; sulfuric acid
OPENEYE Name: (3Z)-1-(2-ethyl-6-methyl-phenyl)-3-(1-methylpyrrolidin-2-ylidene)urea; sulfuric acid
IUPAC Name: (3Z)-1-(2-ethyl-6-methylphenyl)-3-(1-methylpyrrolidin-2-ylidene)urea; sulfuric acid
SYSTEMATIC NAME: (3Z)-1-(2-ethyl-6-methyl-phenyl)-3-(1-methylpyrrolidin-2-ylidene)urea; sulfuric acid
MOLECULAR FORMULA: C15H23N3O5S
MOLECULAR WEIGHT: 357.42522
SMILES: CCC1=CC=CC(=C1NC(=O)/N=C\2/CCCN2C)C.OS(=O)(=O)O
Structure:

CAS RN: 50486-90-3
CAS Name: (3Z)-1-(2-chloro-6-methylphenyl)-3-(1-methyl-2-pyrrolidinylidene)urea
OPENEYE Name: (3Z)-1-(2-chloro-6-methyl-phenyl)-3-(1-methylpyrrolidin-2-ylidene)urea
IUPAC Name: (3Z)-1-(2-chloro-6-methylphenyl)-3-(1-methylpyrrolidin-2-ylidene)urea
SYSTEMATIC NAME: (3Z)-1-(2-chloranyl-6-methyl-phenyl)-3-(1-methylpyrrolidin-2-ylidene)urea
MOLECULAR FORMULA: C13H16ClN3O
MOLECULAR WEIGHT: 265.73864
SMILES: CC1=C(C(=CC=C1)Cl)NC(=O)/N=C\2/CCCN2C
Structure:

CAS RN: 40236-09-7
CAS Name: [(Z)-1-[4-methyl-2-[(E)-2-(5-nitro-2-furanyl)ethenyl]-5-thiazolyl]ethylideneamino]thiourea
OPENEYE Name: [(Z)-1-[4-methyl-2-[(E)-2-(5-nitro-2-furyl)vinyl]thiazol-5-yl]ethylideneamino]thiourea
IUPAC Name: [(Z)-1-[4-methyl-2-[(E)-2-(5-nitrofuran-2-yl)ethenyl]-1,3-thiazol-5-yl]ethylideneamino]thiourea
SYSTEMATIC NAME: 1-[(Z)-1-[4-methyl-2-[(E)-2-(5-nitrofuran-2-yl)ethenyl]-1,3-thiazol-5-yl]ethylideneamino]thiourea
MOLECULAR FORMULA: C13H13N5O3S2
MOLECULAR WEIGHT: 351.40402
SMILES: CC1=C(SC(=N1)/C=C/C2=CC=C(O2)[N+](=O)[O-])/C(=N\NC(=S)N)/C
Structure:

CAS RN: 75323-82-9
CAS Name: [(E)-(3',6'-dihydroxy-1-spiro[isobenzofuran-3,9'-xanthene]ylidene)amino]thiourea
OPENEYE Name: [(E)-(3',6'-dihydroxyspiro[isobenzofuran-3,9'-xanthene]-1-ylidene)amino]thiourea
IUPAC Name: [(E)-(3',6'-dihydroxyspiro[2-benzofuran-3,9'-xanthene]-1-ylidene)amino]thiourea
SYSTEMATIC NAME: 1-[(E)-[3',6'-bis(oxidanyl)spiro[2-benzofuran-3,9'-xanthene]-1-ylidene]amino]thiourea
MOLECULAR FORMULA: C21H15N3O4S
MOLECULAR WEIGHT: 405.4265
SMILES: C1=CC=C2C(=C1)/C(=N\NC(=S)N)/OC23C4=C(C=C(C=C4)O)OC5=C3C=CC(=C5)O
Structure:

CAS RN: 23576-95-6
CAS Name: [(Z)-1-(5-bromo-2-thiophenyl)propylideneamino]thiourea
OPENEYE Name: [(Z)-1-(5-bromo-2-thienyl)propylideneamino]thiourea
IUPAC Name: [(Z)-1-(5-bromothiophen-2-yl)propylideneamino]thiourea
SYSTEMATIC NAME: 1-[(Z)-1-(5-bromanylthiophen-2-yl)propylideneamino]thiourea
MOLECULAR FORMULA: C8H10BrN3S2
MOLECULAR WEIGHT: 292.2191
SMILES: CC/C(=N/NC(=S)N)/C1=CC=C(S1)Br
Structure:

CAS RN: 71555-39-0
CAS Name: N-[(Z)-1-(2-pyridinyl)ethylideneamino]-4-morpholinecarbothioamide
OPENEYE Name: N-[(Z)-1-(2-pyridyl)ethylideneamino]morpholine-4-carbothioamide
IUPAC Name: N-[(Z)-1-pyridin-2-ylethylideneamino]morpholine-4-carbothioamide
SYSTEMATIC NAME: N-[(Z)-1-pyridin-2-ylethylideneamino]morpholine-4-carbothioamide
MOLECULAR FORMULA: C12H16N4OS
MOLECULAR WEIGHT: 264.34664
SMILES: C/C(=N/NC(=S)N1CCOCC1)/C2=CC=CC=N2
Structure:

CAS RN: 87958-67-6
CAS Name: 1-methyl-3-[(E)-(4-oxo-3-prop-2-enyl-2-thiazolidinylidene)amino]thiourea
OPENEYE Name: 1-[(E)-(3-allyl-4-oxo-thiazolidin-2-ylidene)amino]-3-methyl-thiourea
IUPAC Name: 1-methyl-3-[(E)-(4-oxo-3-prop-2-enyl-1,3-thiazolidin-2-ylidene)amino]thiourea
SYSTEMATIC NAME: 1-methyl-3-[(E)-(4-oxidanylidene-3-prop-2-enyl-1,3-thiazolidin-2-ylidene)amino]thiourea
MOLECULAR FORMULA: C8H12N4OS2
MOLECULAR WEIGHT: 244.33708
SMILES: CNC(=S)N/N=C/1\N(C(=O)CS1)CC=C
Structure:

CAS RN: 138749-63-0
CAS Name: [(Z)-[2-[(S)-methylsulfinyl]-6-(methylthio)-4-oxo-1-cyclohexa-2,5-dienylidene]amino]urea
OPENEYE Name: [(Z)-[2-methylsulfanyl-6-[(S)-methylsulfinyl]-4-oxo-cyclohexa-2,5-dien-1-ylidene]amino]urea
IUPAC Name: [(Z)-[2-methylsulfanyl-6-[(S)-methylsulfinyl]-4-oxocyclohexa-2,5-dien-1-ylidene]amino]urea
SYSTEMATIC NAME: 1-[(Z)-[2-methylsulfanyl-6-[(S)-methylsulfinyl]-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene]amino]urea
MOLECULAR FORMULA: C9H11N3O3S2
MOLECULAR WEIGHT: 273.33194
SMILES: CSC\1=CC(=O)C=C(/C1=N\NC(=O)N)[S@@](=O)C
Structure:

CAS RN: 120443-16-5
CAS Name: 3-[[(R)-[3-[(E)-2-(7-chloro-2-quinolinyl)ethenyl]phenyl]-[[3-(dimethylamino)-3-oxopropyl]thio]methyl]thio]propanoic acid
OPENEYE Name: 3-[(R)-[3-[(E)-2-(7-chloro-2-quinolyl)vinyl]phenyl]-[3-(dimethylamino)-3-oxo-propyl]sulfanyl-methyl]sulfanylpropanoic acid
IUPAC Name: 3-[(R)-[3-[(E)-2-(7-chloroquinolin-2-yl)ethenyl]phenyl]-[3-(dimethylamino)-3-oxopropyl]sulfanylmethyl]sulfanylpropanoic acid
SYSTEMATIC NAME: 3-[(R)-[3-[(E)-2-(7-chloranylquinolin-2-yl)ethenyl]phenyl]-[3-(dimethylamino)-3-oxidanylidene-propyl]sulfanyl-methyl]sulfanylpropanoic acid
MOLECULAR FORMULA: C26H27ClN2O3S2
MOLECULAR WEIGHT: 515.08718
SMILES: CN(C)C(=O)CCS[C@@H](C1=CC=CC(=C1)/C=C/C2=NC3=C(C=CC(=C3)Cl)C=C2)SCCC(=O)O
Structure:

CAS RN: 73962-31-9
CAS Name: [(Z)-(2-prop-2-ynoxyphenyl)methylideneamino]thiourea
OPENEYE Name: [(Z)-(2-prop-2-ynoxyphenyl)methyleneamino]thiourea
IUPAC Name: [(Z)-(2-prop-2-ynoxyphenyl)methylideneamino]thiourea
SYSTEMATIC NAME: 1-[(Z)-(2-prop-2-ynoxyphenyl)methylideneamino]thiourea
MOLECULAR FORMULA: C11H11N3OS
MOLECULAR WEIGHT: 233.28954
SMILES: C#CCOC1=CC=CC=C1/C=N\NC(=S)N
Structure:

CAS RN: 66969-03-7
CAS Name: [(Z)-1-(3,4,5-trimethylphenyl)ethylideneamino]thiourea
OPENEYE Name: [(Z)-1-(3,4,5-trimethylphenyl)ethylideneamino]thiourea
IUPAC Name: [(Z)-1-(3,4,5-trimethylphenyl)ethylideneamino]thiourea
SYSTEMATIC NAME: 1-[(Z)-1-(3,4,5-trimethylphenyl)ethylideneamino]thiourea
MOLECULAR FORMULA: C12H17N3S
MOLECULAR WEIGHT: 235.34848
SMILES: CC1=CC(=CC(=C1C)C)/C(=N\NC(=S)N)/C
Structure:

CAS RN: 13724-21-5
CAS Name: [(Z)-1-(5-amino-2-octoxyphenyl)ethylideneamino]thiourea
OPENEYE Name: [(Z)-1-(5-amino-2-octoxy-phenyl)ethylideneamino]thiourea
IUPAC Name: [(Z)-1-(5-amino-2-octoxyphenyl)ethylideneamino]thiourea
SYSTEMATIC NAME: 1-[(Z)-1-(5-azanyl-2-octoxy-phenyl)ethylideneamino]thiourea
MOLECULAR FORMULA: C17H28N4OS
MOLECULAR WEIGHT: 336.49542
SMILES: CCCCCCCCOC1=C(C=C(C=C1)N)/C(=N\NC(=S)N)/C
Structure:

CAS RN: 138668-20-9
CAS Name: [(E)-2-nitrohept-1-enyl]cyclohexane
OPENEYE Name: [(E)-2-nitrohept-1-enyl]cyclohexane
IUPAC Name: [(E)-2-nitrohept-1-enyl]cyclohexane
SYSTEMATIC NAME: [(E)-2-nitrohept-1-enyl]cyclohexane
MOLECULAR FORMULA: C13H23NO2
MOLECULAR WEIGHT: 225.32722
SMILES: CCCCC/C(=C\C1CCCCC1)/[N+](=O)[O-]
Structure:

CAS RN: 138668-18-5
CAS Name: (E)-2-nitro-2-penten-1-ol
OPENEYE Name: (E)-2-nitropent-2-en-1-ol
IUPAC Name: (E)-2-nitropent-2-en-1-ol
SYSTEMATIC NAME: (E)-2-nitropent-2-en-1-ol
MOLECULAR FORMULA: C5H9NO3
MOLECULAR WEIGHT: 131.12986
SMILES: CC/C=C(\CO)/[N+](=O)[O-]
Structure:

CAS RN: 104775-22-6
CAS Name: 3-[[(Z)-(3-chloro-5-methyl-6-oxo-1-cyclohexa-2,4-dienylidene)-(4-chlorophenyl)methyl]amino]butanoic acid
OPENEYE Name: 3-[[(Z)-(3-chloro-5-methyl-6-oxo-cyclohexa-2,4-dien-1-ylidene)-(4-chlorophenyl)methyl]amino]butanoic acid
IUPAC Name: 3-[[(Z)-(3-chloro-5-methyl-6-oxocyclohexa-2,4-dien-1-ylidene)-(4-chlorophenyl)methyl]amino]butanoic acid
SYSTEMATIC NAME: 3-[[(Z)-(3-chloranyl-5-methyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)-(4-chlorophenyl)methyl]amino]butanoic acid
MOLECULAR FORMULA: C18H17Cl2NO3
MOLECULAR WEIGHT: 366.23848
SMILES: CC1=CC(=C/C(=C(\C2=CC=C(C=C2)Cl)/NC(C)CC(=O)O)/C1=O)Cl
Structure:

CAS RN: 104775-11-3
CAS Name: 6-[[(Z)-(3-chloro-5-methyl-6-oxo-1-cyclohexa-2,4-dienylidene)-(4-chlorophenyl)methyl]amino]heptanoic acid
OPENEYE Name: 6-[[(Z)-(3-chloro-5-methyl-6-oxo-cyclohexa-2,4-dien-1-ylidene)-(4-chlorophenyl)methyl]amino]heptanoic acid
IUPAC Name: 6-[[(Z)-(3-chloro-5-methyl-6-oxocyclohexa-2,4-dien-1-ylidene)-(4-chlorophenyl)methyl]amino]heptanoic acid
SYSTEMATIC NAME: 6-[[(Z)-(3-chloranyl-5-methyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)-(4-chlorophenyl)methyl]amino]heptanoic acid
MOLECULAR FORMULA: C21H23Cl2NO3
MOLECULAR WEIGHT: 408.31822
SMILES: CC1=CC(=C/C(=C(\C2=CC=C(C=C2)Cl)/NC(C)CCCCC(=O)O)/C1=O)Cl
Structure:

CAS RN: 104775-06-6
CAS Name: 4-[[(Z)-(3-chloro-5-methyl-6-oxo-1-cyclohexa-2,4-dienylidene)-(4-chlorophenyl)methyl]amino]pentanoic acid methyl ester
OPENEYE Name: methyl 4-[[(Z)-(3-chloro-5-methyl-6-oxo-cyclohexa-2,4-dien-1-ylidene)-(4-chlorophenyl)methyl]amino]pentanoate
IUPAC Name: methyl 4-[[(Z)-(3-chloro-5-methyl-6-oxocyclohexa-2,4-dien-1-ylidene)-(4-chlorophenyl)methyl]amino]pentanoate
SYSTEMATIC NAME: methyl 4-[[(Z)-(3-chloranyl-5-methyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)-(4-chlorophenyl)methyl]amino]pentanoate
MOLECULAR FORMULA: C20H21Cl2NO3
MOLECULAR WEIGHT: 394.29164
SMILES: CC1=CC(=C/C(=C(\C2=CC=C(C=C2)Cl)/NC(C)CCC(=O)OC)/C1=O)Cl
Structure:

CAS RN: 104775-04-4
CAS Name: 4-[[(Z)-(3-chloro-5-methyl-6-oxo-1-cyclohexa-2,4-dienylidene)-(4-chlorophenyl)methyl]amino]pentanamide
OPENEYE Name: 4-[[(Z)-(3-chloro-5-methyl-6-oxo-cyclohexa-2,4-dien-1-ylidene)-(4-chlorophenyl)methyl]amino]pentanamide
IUPAC Name: 4-[[(Z)-(3-chloro-5-methyl-6-oxocyclohexa-2,4-dien-1-ylidene)-(4-chlorophenyl)methyl]amino]pentanamide
SYSTEMATIC NAME: 4-[[(Z)-(3-chloranyl-5-methyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)-(4-chlorophenyl)methyl]amino]pentanamide
MOLECULAR FORMULA: C19H20Cl2N2O2
MOLECULAR WEIGHT: 379.2803
SMILES: CC1=CC(=C/C(=C(\C2=CC=C(C=C2)Cl)/NC(C)CCC(=O)N)/C1=O)Cl
Structure:

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