Sunday, January 22, 2012

http://ChemLookup.com Compounds




CAS RN: 135586-95-7
CAS Name: N-(2-cyano-1-spiro[4H-naphthalene-3,1'-cyclohexane]yl)methanimidic acid ethyl ester
OPENEYE Name: ethyl N-(2-cyanospiro[4H-naphthalene-3,1'-cyclohexane]-1-yl)methanimidate
IUPAC Name: ethyl N-(2-cyanospiro[4H-naphthalene-3,1'-cyclohexane]-1-yl)methanimidate
SYSTEMATIC NAME: ethyl N-(2-cyanospiro[4H-naphthalene-3,1'-cyclohexane]-1-yl)methanimidate
MOLECULAR FORMULA: C19H22N2O
MOLECULAR WEIGHT: 294.39078
SMILES: CCOC=NC1=C(C2(CCCCC2)CC3=CC=CC=C31)C#N
Structure:

CAS RN: 135575-64-3
CAS Name: 3-[5-[(3-anilino-2-hydroxypropyl)thio]-1,3,4-thiadiazol-2-yl]-6-iodo-2-methyl-4-quinazolinone
OPENEYE Name: 3-[5-(3-anilino-2-hydroxy-propyl)sulfanyl-1,3,4-thiadiazol-2-yl]-6-iodo-2-methyl-quinazolin-4-one
IUPAC Name: 3-[5-(3-anilino-2-hydroxypropyl)sulfanyl-1,3,4-thiadiazol-2-yl]-6-iodo-2-methylquinazolin-4-one
SYSTEMATIC NAME: 6-iodanyl-2-methyl-3-[5-(2-oxidanyl-3-phenylazanyl-propyl)sulfanyl-1,3,4-thiadiazol-2-yl]quinazolin-4-one
MOLECULAR FORMULA: C20H18IN5O2S2
MOLECULAR WEIGHT: 551.42369
SMILES: CC1=NC2=C(C=C(C=C2)I)C(=O)N1C3=NN=C(S3)SCC(CNC4=CC=CC=C4)O
Structure:

CAS RN: 135521-80-1
CAS Name: 9-chloro-2-methoxy-4-(1-naphthalenyl)-5H-thiochromeno[4,3-b]pyridine-3-carbonitrile
OPENEYE Name: 9-chloro-2-methoxy-4-(1-naphthyl)-5H-thiochromeno[4,3-b]pyridine-3-carbonitrile
IUPAC Name: 9-chloro-2-methoxy-4-naphthalen-1-yl-5H-thiochromeno[4,3-b]pyridine-3-carbonitrile
SYSTEMATIC NAME: 9-chloranyl-2-methoxy-4-naphthalen-1-yl-5H-thiochromeno[4,3-b]pyridine-3-carbonitrile
MOLECULAR FORMULA: C24H15ClN2OS
MOLECULAR WEIGHT: 414.9067
SMILES: COC1=NC2=C(CSC3=C2C=C(C=C3)Cl)C(=C1C#N)C4=CC=CC5=CC=CC=C54
Structure:

CAS RN: 135521-79-8
CAS Name: 9-chloro-4-(3,4-dimethoxyphenyl)-2-methoxy-5H-thiochromeno[4,3-b]pyridine-3-carbonitrile
OPENEYE Name: 9-chloro-4-(3,4-dimethoxyphenyl)-2-methoxy-5H-thiochromeno[4,3-b]pyridine-3-carbonitrile
IUPAC Name: 9-chloro-4-(3,4-dimethoxyphenyl)-2-methoxy-5H-thiochromeno[4,3-b]pyridine-3-carbonitrile
SYSTEMATIC NAME: 9-chloranyl-4-(3,4-dimethoxyphenyl)-2-methoxy-5H-thiochromeno[4,3-b]pyridine-3-carbonitrile
MOLECULAR FORMULA: C22H17ClN2O3S
MOLECULAR WEIGHT: 424.89998
SMILES: COC1=C(C=C(C=C1)C2=C(C(=NC3=C2CSC4=C3C=C(C=C4)Cl)OC)C#N)OC
Structure:

CAS RN: 135521-78-7
CAS Name: 9-chloro-4-(3-hydroxy-4-methoxyphenyl)-2-methoxy-5H-thiochromeno[4,3-b]pyridine-3-carbonitrile
OPENEYE Name: 9-chloro-4-(3-hydroxy-4-methoxy-phenyl)-2-methoxy-5H-thiochromeno[4,3-b]pyridine-3-carbonitrile
IUPAC Name: 9-chloro-4-(3-hydroxy-4-methoxyphenyl)-2-methoxy-5H-thiochromeno[4,3-b]pyridine-3-carbonitrile
SYSTEMATIC NAME: 9-chloranyl-2-methoxy-4-(4-methoxy-3-oxidanyl-phenyl)-5H-thiochromeno[4,3-b]pyridine-3-carbonitrile
MOLECULAR FORMULA: C21H15ClN2O3S
MOLECULAR WEIGHT: 410.8734
SMILES: COC1=C(C=C(C=C1)C2=C(C(=NC3=C2CSC4=C3C=C(C=C4)Cl)OC)C#N)O
Structure:

CAS RN: 135521-76-5
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C20H16N2O4S
MOLECULAR WEIGHT: 380.41704
SMILES: C1C2=C3C4=C(C=C(C=C4)C5=CC=C(C=C5)O)NNC3=COC2C=CS1(=O)=O
Structure:

CAS RN: 135521-75-4
CAS Name: 2-amino-4-(1,3-benzodioxol-5-yl)-9-chloro-4,5-dihydrothiochromeno[4,3-b]pyran-3-carbonitrile
OPENEYE Name: 2-amino-4-(1,3-benzodioxol-5-yl)-9-chloro-4,5-dihydrothiochromeno[4,3-b]pyran-3-carbonitrile
IUPAC Name: 2-amino-4-(1,3-benzodioxol-5-yl)-9-chloro-4,5-dihydrothiochromeno[4,3-b]pyran-3-carbonitrile
SYSTEMATIC NAME: 2-azanyl-4-(1,3-benzodioxol-5-yl)-9-chloranyl-4,5-dihydrothiochromeno[4,3-b]pyran-3-carbonitrile
MOLECULAR FORMULA: C20H13ClN2O3S
MOLECULAR WEIGHT: 396.84682
SMILES: C1C2=C(C3=C(S1)C=CC(=C3)Cl)OC(=C(C2C4=CC5=C(C=C4)OCO5)C#N)N
Structure:

CAS RN: 135521-74-3
CAS Name: 2-amino-9-chloro-4-phenyl-4,5-dihydrothiochromeno[4,3-b]pyran-3-carbonitrile
OPENEYE Name: 2-amino-9-chloro-4-phenyl-4,5-dihydrothiochromeno[4,3-b]pyran-3-carbonitrile
IUPAC Name: 2-amino-9-chloro-4-phenyl-4,5-dihydrothiochromeno[4,3-b]pyran-3-carbonitrile
SYSTEMATIC NAME: 2-azanyl-9-chloranyl-4-phenyl-4,5-dihydrothiochromeno[4,3-b]pyran-3-carbonitrile
MOLECULAR FORMULA: C19H13ClN2OS
MOLECULAR WEIGHT: 352.83732
SMILES: C1C2=C(C3=C(S1)C=CC(=C3)Cl)OC(=C(C2C4=CC=CC=C4)C#N)N
Structure:

CAS RN: 135521-71-0
CAS Name: (1R,8S)-1-hydroxy-1-phenyl-5,6,7,8-tetrahydro-2H-pyrrolizin-3-one
OPENEYE Name: (1R,8S)-1-hydroxy-1-phenyl-5,6,7,8-tetrahydro-2H-pyrrolizin-3-one
IUPAC Name: (1R,8S)-1-hydroxy-1-phenyl-5,6,7,8-tetrahydro-2H-pyrrolizin-3-one
SYSTEMATIC NAME: (1R,8S)-1-oxidanyl-1-phenyl-5,6,7,8-tetrahydro-2H-pyrrolizin-3-one
MOLECULAR FORMULA: C13H15NO2
MOLECULAR WEIGHT: 217.2637
SMILES: C1C[C@H]2[C@@](CC(=O)N2C1)(C3=CC=CC=C3)O
Structure:

CAS RN: 135518-37-5
CAS Name: 4-amino-3-[(4-fluorophenyl)methylthio]-5-thieno[2,3-c]isothiazolecarbonitrile
OPENEYE Name: 4-amino-3-[(4-fluorophenyl)methylsulfanyl]thieno[2,3-c]isothiazole-5-carbonitrile
IUPAC Name: 4-amino-3-[(4-fluorophenyl)methylsulfanyl]thieno[2,3-c][1,2]thiazole-5-carbonitrile
SYSTEMATIC NAME: 4-azanyl-3-[(4-fluorophenyl)methylsulfanyl]thieno[2,3-c][1,2]thiazole-5-carbonitrile
MOLECULAR FORMULA: C13H8FN3S3
MOLECULAR WEIGHT: 321.416123
SMILES: C1=CC(=CC=C1CSC2=C3C(=C(SC3=NS2)C#N)N)F
Structure:

CAS RN: 135518-36-4
CAS Name: 5-(cyanomethylthio)-3-(propylthio)-4-isothiazolecarbonitrile
OPENEYE Name: 5-(cyanomethylsulfanyl)-3-propylsulfanyl-isothiazole-4-carbonitrile
IUPAC Name: 5-(cyanomethylsulfanyl)-3-propylsulfanyl-1,2-thiazole-4-carbonitrile
SYSTEMATIC NAME: 5-(cyanomethylsulfanyl)-3-propylsulfanyl-1,2-thiazole-4-carbonitrile
MOLECULAR FORMULA: C9H9N3S3
MOLECULAR WEIGHT: 255.38286
SMILES: CCCSC1=NSC(=C1C#N)SCC#N
Structure:

CAS RN: 135518-35-3
CAS Name: 4-amino-3-(propylthio)-5-thieno[3,2-d]isothiazolecarboxamide
OPENEYE Name: 4-amino-3-propylsulfanyl-thieno[3,2-d]isothiazole-5-carboxamide
IUPAC Name: 4-amino-3-propylsulfanylthieno[3,2-d][1,2]thiazole-5-carboxamide
SYSTEMATIC NAME: 4-azanyl-3-propylsulfanyl-thieno[3,2-d][1,2]thiazole-5-carboxamide
MOLECULAR FORMULA: C9H11N3OS3
MOLECULAR WEIGHT: 273.39814
SMILES: CCCSC1=NSC2=C1C(=C(S2)C(=O)N)N
Structure:

CAS RN: 135518-34-2
CAS Name: 4-amino-3-[(4-fluorophenyl)methylthio]-5-thieno[3,2-d]isothiazolecarbonitrile
OPENEYE Name: 4-amino-3-[(4-fluorophenyl)methylsulfanyl]thieno[3,2-d]isothiazole-5-carbonitrile
IUPAC Name: 4-amino-3-[(4-fluorophenyl)methylsulfanyl]thieno[3,2-d][1,2]thiazole-5-carbonitrile
SYSTEMATIC NAME: 4-azanyl-3-[(4-fluorophenyl)methylsulfanyl]thieno[3,2-d][1,2]thiazole-5-carbonitrile
MOLECULAR FORMULA: C13H8FN3S3
MOLECULAR WEIGHT: 321.416123
SMILES: C1=CC(=CC=C1CSC2=NSC3=C2C(=C(S3)C#N)N)F
Structure:

CAS RN: 135518-33-1
CAS Name: 4-amino-3-[(4-fluorophenyl)methylthio]-5-thieno[2,3-c]isothiazolecarboxamide
OPENEYE Name: 4-amino-3-[(4-fluorophenyl)methylsulfanyl]thieno[2,3-c]isothiazole-5-carboxamide
IUPAC Name: 4-amino-3-[(4-fluorophenyl)methylsulfanyl]thieno[2,3-c][1,2]thiazole-5-carboxamide
SYSTEMATIC NAME: 4-azanyl-3-[(4-fluorophenyl)methylsulfanyl]thieno[2,3-c][1,2]thiazole-5-carboxamide
MOLECULAR FORMULA: C13H10FN3OS3
MOLECULAR WEIGHT: 339.431403
SMILES: C1=CC(=CC=C1CSC2=C3C(=C(SC3=NS2)C(=O)N)N)F
Structure:

CAS RN: 135518-32-0
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C7H4N4OS3
MOLECULAR WEIGHT: 256.32786
SMILES: CSC1=NSC2=C1C3=C(S2)C(=O)N=NN3
Structure:

CAS RN: 135518-31-9
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C13H6ClFN4S3
MOLECULAR WEIGHT: 368.859943
SMILES: C1=CC(=CC=C1CSC2=C3C4=C(C(=NN=N4)Cl)SC3=NS2)F
Structure:

CAS RN: 135489-26-8
CAS Name: 4-amino-3-(phenylmethylthio)-5-thieno[2,3-c]isothiazolecarboxamide
OPENEYE Name: 4-amino-3-benzylsulfanyl-thieno[2,3-c]isothiazole-5-carboxamide
IUPAC Name: 4-amino-3-benzylsulfanylthieno[2,3-c][1,2]thiazole-5-carboxamide
SYSTEMATIC NAME: 4-azanyl-3-(phenylmethylsulfanyl)thieno[2,3-c][1,2]thiazole-5-carboxamide
MOLECULAR FORMULA: C13H11N3OS3
MOLECULAR WEIGHT: 321.44094
SMILES: C1=CC=C(C=C1)CSC2=C3C(=C(SC3=NS2)C(=O)N)N
Structure:

CAS RN: 135489-25-7
CAS Name: 4-amino-3-(propylthio)-5-thieno[2,3-c]isothiazolecarboxamide
OPENEYE Name: 4-amino-3-propylsulfanyl-thieno[2,3-c]isothiazole-5-carboxamide
IUPAC Name: 4-amino-3-propylsulfanylthieno[2,3-c][1,2]thiazole-5-carboxamide
SYSTEMATIC NAME: 4-azanyl-3-propylsulfanyl-thieno[2,3-c][1,2]thiazole-5-carboxamide
MOLECULAR FORMULA: C9H11N3OS3
MOLECULAR WEIGHT: 273.39814
SMILES: CCCSC1=C2C(=C(SC2=NS1)C(=O)N)N
Structure:

CAS RN: 135489-24-6
CAS Name: 4-amino-3-(propylthio)-5-thieno[2,3-c]isothiazolecarbonitrile
OPENEYE Name: 4-amino-3-propylsulfanyl-thieno[2,3-c]isothiazole-5-carbonitrile
IUPAC Name: 4-amino-3-propylsulfanylthieno[2,3-c][1,2]thiazole-5-carbonitrile
SYSTEMATIC NAME: 4-azanyl-3-propylsulfanyl-thieno[2,3-c][1,2]thiazole-5-carbonitrile
MOLECULAR FORMULA: C9H9N3S3
MOLECULAR WEIGHT: 255.38286
SMILES: CCCSC1=C2C(=C(SC2=NS1)C#N)N
Structure:

CAS RN: 135489-23-5
CAS Name: 2-[[4-cyano-3-[(4-fluorophenyl)methylthio]-5-isothiazolyl]thio]acetamide
OPENEYE Name: 2-[4-cyano-3-[(4-fluorophenyl)methylsulfanyl]isothiazol-5-yl]sulfanylacetamide
IUPAC Name: 2-[[4-cyano-3-[(4-fluorophenyl)methylsulfanyl]-1,2-thiazol-5-yl]sulfanyl]acetamide
SYSTEMATIC NAME: 2-[[4-cyano-3-[(4-fluorophenyl)methylsulfanyl]-1,2-thiazol-5-yl]sulfanyl]ethanamide
MOLECULAR FORMULA: C13H10FN3OS3
MOLECULAR WEIGHT: 339.431403
SMILES: C1=CC(=CC=C1CSC2=NSC(=C2C#N)SCC(=O)N)F
Structure:

CAS RN: 135489-22-4
CAS Name: 2-[[4-cyano-3-(phenylmethylthio)-5-isothiazolyl]thio]acetamide
OPENEYE Name: 2-(3-benzylsulfanyl-4-cyano-isothiazol-5-yl)sulfanylacetamide
IUPAC Name: 2-[(3-benzylsulfanyl-4-cyano-1,2-thiazol-5-yl)sulfanyl]acetamide
SYSTEMATIC NAME: 2-[[4-cyano-3-(phenylmethylsulfanyl)-1,2-thiazol-5-yl]sulfanyl]ethanamide
MOLECULAR FORMULA: C13H11N3OS3
MOLECULAR WEIGHT: 321.44094
SMILES: C1=CC=C(C=C1)CSC2=NSC(=C2C#N)SCC(=O)N
Structure:

CAS RN: 135489-21-3
CAS Name: 2-[[4-cyano-3-(propylthio)-5-isothiazolyl]thio]acetamide
OPENEYE Name: 2-(4-cyano-3-propylsulfanyl-isothiazol-5-yl)sulfanylacetamide
IUPAC Name: 2-[(4-cyano-3-propylsulfanyl-1,2-thiazol-5-yl)sulfanyl]acetamide
SYSTEMATIC NAME: 2-[(4-cyano-3-propylsulfanyl-1,2-thiazol-5-yl)sulfanyl]ethanamide
MOLECULAR FORMULA: C9H11N3OS3
MOLECULAR WEIGHT: 273.39814
SMILES: CCCSC1=NSC(=C1C#N)SCC(=O)N
Structure:

CAS RN: 135489-20-2
CAS Name: 5-(cyanomethylthio)-3-[(4-fluorophenyl)methylthio]-4-isothiazolecarbonitrile
OPENEYE Name: 5-(cyanomethylsulfanyl)-3-[(4-fluorophenyl)methylsulfanyl]isothiazole-4-carbonitrile
IUPAC Name: 5-(cyanomethylsulfanyl)-3-[(4-fluorophenyl)methylsulfanyl]-1,2-thiazole-4-carbonitrile
SYSTEMATIC NAME: 5-(cyanomethylsulfanyl)-3-[(4-fluorophenyl)methylsulfanyl]-1,2-thiazole-4-carbonitrile
MOLECULAR FORMULA: C13H8FN3S3
MOLECULAR WEIGHT: 321.416123
SMILES: C1=CC(=CC=C1CSC2=NSC(=C2C#N)SCC#N)F
Structure:

CAS RN: 135489-19-9
CAS Name: 2-[[4-cyano-5-[(4-fluorophenyl)methylthio]-3-isothiazolyl]thio]acetamide
OPENEYE Name: 2-[4-cyano-5-[(4-fluorophenyl)methylsulfanyl]isothiazol-3-yl]sulfanylacetamide
IUPAC Name: 2-[[4-cyano-5-[(4-fluorophenyl)methylsulfanyl]-1,2-thiazol-3-yl]sulfanyl]acetamide
SYSTEMATIC NAME: 2-[[4-cyano-5-[(4-fluorophenyl)methylsulfanyl]-1,2-thiazol-3-yl]sulfanyl]ethanamide
MOLECULAR FORMULA: C13H10FN3OS3
MOLECULAR WEIGHT: 339.431403
SMILES: C1=CC(=CC=C1CSC2=C(C(=NS2)SCC(=O)N)C#N)F
Structure:

CAS RN: 135489-18-8
CAS Name: 2-[[4-cyano-5-(phenylmethylthio)-3-isothiazolyl]thio]acetamide
OPENEYE Name: 2-(5-benzylsulfanyl-4-cyano-isothiazol-3-yl)sulfanylacetamide
IUPAC Name: 2-[(5-benzylsulfanyl-4-cyano-1,2-thiazol-3-yl)sulfanyl]acetamide
SYSTEMATIC NAME: 2-[[4-cyano-5-(phenylmethylsulfanyl)-1,2-thiazol-3-yl]sulfanyl]ethanamide
MOLECULAR FORMULA: C13H11N3OS3
MOLECULAR WEIGHT: 321.44094
SMILES: C1=CC=C(C=C1)CSC2=C(C(=NS2)SCC(=O)N)C#N
Structure:

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