CAS RN: 60965-60-8
CAS Name: 5-methyl-2-furanthiol
OPENEYE Name: 5-methylfuran-2-thiol
IUPAC Name: 5-methylfuran-2-thiol
SYSTEMATIC NAME: 5-methylfuran-2-thiol
MOLECULAR FORMULA: C5H6OS
MOLECULAR WEIGHT: 114.16554
SMILES: CC1=CC=C(O1)S
Structure:
CAS RN: 60964-67-2
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C12H14O
MOLECULAR WEIGHT: 174.23896
SMILES: C1C=CCC23C1(CC=CC2)CC3=O
Structure:
CAS RN: 7239-76-1
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C12H14O
MOLECULAR WEIGHT: 174.23896
SMILES: C1C=CCC23C1(CC=CC2)CC3=O
Structure:
CAS RN: 60956-24-3
CAS Name: 1,2-dibromo-4-chlorobenzene
OPENEYE Name: 1,2-dibromo-4-chloro-benzene
IUPAC Name: 1,2-dibromo-4-chlorobenzene
SYSTEMATIC NAME: 1,2-bis(bromanyl)-4-chloranyl-benzene
MOLECULAR FORMULA: C6H3Br2Cl
MOLECULAR WEIGHT: 270.34902
SMILES: C1=CC(=C(C=C1Cl)Br)Br
Structure:
CAS RN: 60948-99-4
CAS Name: [8-(mercaptomethyl)-1-naphthalenyl]methanethiol
OPENEYE Name: [8-(sulfanylmethyl)-1-naphthyl]methanethiol
IUPAC Name: [8-(sulfanylmethyl)naphthalen-1-yl]methanethiol
SYSTEMATIC NAME: [8-(sulfanylmethyl)naphthalen-1-yl]methanethiol
MOLECULAR FORMULA: C12H12S2
MOLECULAR WEIGHT: 220.35368
SMILES: C1=CC2=C(C(=C1)CS)C(=CC=C2)CS
Structure:
CAS RN: 60917-67-1
CAS Name: 1-(5-bromo-2,4-dimethoxyphenyl)-2-propanamine
OPENEYE Name: 1-(5-bromo-2,4-dimethoxy-phenyl)propan-2-amine
IUPAC Name: 1-(5-bromo-2,4-dimethoxyphenyl)propan-2-amine
SYSTEMATIC NAME: 1-(5-bromanyl-2,4-dimethoxy-phenyl)propan-2-amine
MOLECULAR FORMULA: C11H16BrNO2
MOLECULAR WEIGHT: 274.15424
SMILES: CC(CC1=CC(=C(C=C1OC)OC)Br)N
Structure:
CAS RN: 60836-07-9
CAS Name: 2,4,6-trimethyl-4-heptanol
OPENEYE Name: 2,4,6-trimethylheptan-4-ol
IUPAC Name: 2,4,6-trimethylheptan-4-ol
SYSTEMATIC NAME: 2,4,6-trimethylheptan-4-ol
MOLECULAR FORMULA: C10H22O
MOLECULAR WEIGHT: 158.28108
SMILES: CC(C)CC(C)(CC(C)C)O
Structure:
CAS RN: 60835-69-0
CAS Name: 17-nitro-2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(15),16,18-triene
OPENEYE Name: 17-nitro-2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(15),16,18-triene
IUPAC Name: 17-nitro-2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(15),16,18-triene
SYSTEMATIC NAME: 17-nitro-2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(15),16,18-triene
MOLECULAR FORMULA: C14H19NO7
MOLECULAR WEIGHT: 313.30316
SMILES: C1COCCOC2=C(C=C(C=C2)[N+](=O)[O-])OCCOCCO1
Structure:
CAS RN: 60778-60-1
CAS Name: 1-(1-piperidinyl)azepane
OPENEYE Name: 1-(1-piperidyl)azepane
IUPAC Name: 1-piperidin-1-ylazepane
SYSTEMATIC NAME: 1-piperidin-1-ylazepane
MOLECULAR FORMULA: C11H22N2
MOLECULAR WEIGHT: 182.30578
SMILES: C1CCCN(CC1)N2CCCCC2
Structure:
CAS RN: 60743-10-4
CAS Name: 1,3-dithietane 1,1,3-trioxide
OPENEYE Name: 1,3-dithietane 1,1,3-trioxide
IUPAC Name: 1,3-dithietane 1,1,3-trioxide
SYSTEMATIC NAME: 1,3-dithietane 1,1,3-trioxide
MOLECULAR FORMULA: C2H4O3S2
MOLECULAR WEIGHT: 140.18136
SMILES: C1S(=O)CS1(=O)=O
Structure:
CAS RN: 60743-08-0
CAS Name: 1,3-dithietane 1,3-dioxide
OPENEYE Name: 1,3-dithietane 1,3-dioxide
IUPAC Name: 1,3-dithietane 1,3-dioxide
SYSTEMATIC NAME: 1,3-dithietane 1,3-dioxide
MOLECULAR FORMULA: C2H4O2S2
MOLECULAR WEIGHT: 124.18196
SMILES: C1S(=O)CS1=O
Structure:
CAS RN: 60743-07-9
CAS Name: 1,3-dithietane 1,1-dioxide
OPENEYE Name: 1,3-dithietane 1,1-dioxide
IUPAC Name: 1,3-dithietane 1,1-dioxide
SYSTEMATIC NAME: 1,3-dithietane 1,1-dioxide
MOLECULAR FORMULA: C2H4O2S2
MOLECULAR WEIGHT: 124.18196
SMILES: C1SCS1(=O)=O
Structure:
CAS RN: 60736-71-2
CAS Name: 4-(chloromethyl)-1-methoxy-2-methylbenzene
OPENEYE Name: 4-(chloromethyl)-1-methoxy-2-methyl-benzene
IUPAC Name: 4-(chloromethyl)-1-methoxy-2-methylbenzene
SYSTEMATIC NAME: 4-(chloromethyl)-1-methoxy-2-methyl-benzene
MOLECULAR FORMULA: C9H11ClO
MOLECULAR WEIGHT: 170.63604
SMILES: CC1=C(C=CC(=C1)CCl)OC
Structure:
CAS RN: 60728-51-0
CAS Name: N,N-bis(prop-2-enyl)carbamic acid ethyl ester
OPENEYE Name: ethyl N,N-diallylcarbamate
IUPAC Name: ethyl N,N-bis(prop-2-enyl)carbamate
SYSTEMATIC NAME: ethyl N,N-bis(prop-2-enyl)carbamate
MOLECULAR FORMULA: C9H15NO2
MOLECULAR WEIGHT: 169.2209
SMILES: CCOC(=O)N(CC=C)CC=C
Structure:
CAS RN: 60706-63-0
CAS Name: 2,3,5,6-tetramethylbenzenesulfonyl chloride
OPENEYE Name: 2,3,5,6-tetramethylbenzenesulfonyl chloride
IUPAC Name: 2,3,5,6-tetramethylbenzenesulfonyl chloride
SYSTEMATIC NAME: 2,3,5,6-tetramethylbenzenesulfonyl chloride
MOLECULAR FORMULA: C10H13ClO2S
MOLECULAR WEIGHT: 232.72702
SMILES: CC1=CC(=C(C(=C1C)S(=O)(=O)Cl)C)C
Structure:
CAS RN: 60703-00-6
CAS Name: deuterioformic acid propan-2-yl ester
OPENEYE Name: isopropyl deuterioformate
IUPAC Name: propan-2-yl deuterioformate
SYSTEMATIC NAME: propan-2-yl deuteriomethanoate
MOLECULAR FORMULA: C4H8O2
MOLECULAR WEIGHT: 89.111282
SMILES: [2H]C(=O)OC(C)C
Structure:
CAS RN: 60700-47-2
CAS Name: 1,4,5,6,7,10,11,12-octahydrotetracene
OPENEYE Name: 1,4,5,6,7,10,11,12-octahydrotetracene
IUPAC Name: 1,4,5,6,7,10,11,12-octahydrotetracene
SYSTEMATIC NAME: 1,4,5,6,7,10,11,12-octahydrotetracene
MOLECULAR FORMULA: C18H20
MOLECULAR WEIGHT: 236.3514
SMILES: C1C=CCC2=C1CC3=C(C2)CC4=C(C3)CC=CC4
Structure:
CAS RN: 60694-92-0
CAS Name: 4-(2-iodo-1-oxoethyl)benzonitrile
OPENEYE Name: 4-(2-iodoacetyl)benzonitrile
IUPAC Name: 4-(2-iodoacetyl)benzonitrile
SYSTEMATIC NAME: 4-(2-iodanylethanoyl)benzenecarbonitrile
MOLECULAR FORMULA: C9H6INO
MOLECULAR WEIGHT: 271.05451
SMILES: C1=CC(=CC=C1C#N)C(=O)CI
Structure:
CAS RN: 60681-10-9
CAS Name: 4,4,6,6-tetramethylcyclohexane-1,3-dione
OPENEYE Name: 4,4,6,6-tetramethylcyclohexane-1,3-dione
IUPAC Name: 4,4,6,6-tetramethylcyclohexane-1,3-dione
SYSTEMATIC NAME: 4,4,6,6-tetramethylcyclohexane-1,3-dione
MOLECULAR FORMULA: C10H16O2
MOLECULAR WEIGHT: 168.23284
SMILES: CC1(CC(C(=O)CC1=O)(C)C)C
Structure:
CAS RN: 60678-83-3
CAS Name: 1,2,3,4,6,6a,7,8,9,10,10a,11-dodecahydropyridazino[1,2-b]phthalazine
OPENEYE Name: 1,2,3,4,6,6a,7,8,9,10,10a,11-dodecahydropyridazino[1,2-b]phthalazine
IUPAC Name: 1,2,3,4,6,6a,7,8,9,10,10a,11-dodecahydropyridazino[1,2-b]phthalazine
SYSTEMATIC NAME: 1,2,3,4,6,6a,7,8,9,10,10a,11-dodecahydropyridazino[1,2-b]phthalazine
MOLECULAR FORMULA: C12H22N2
MOLECULAR WEIGHT: 194.31648
SMILES: C1CCC2CN3CCCCN3CC2C1
Structure:
CAS RN: 60678-82-2
CAS Name: 1,2-diethyldiazinane
OPENEYE Name: 1,2-diethylhexahydropyridazine
IUPAC Name: 1,2-diethyldiazinane
SYSTEMATIC NAME: 1,2-diethyl-1,2-diazinane
MOLECULAR FORMULA: C8H18N2
MOLECULAR WEIGHT: 142.24192
SMILES: CCN1CCCCN1CC
Structure:
CAS RN: 60678-80-0
CAS Name: 1,2,3,3,6,6-hexamethyldiazinane
OPENEYE Name: 1,2,3,3,6,6-hexamethylhexahydropyridazine
IUPAC Name: 1,2,3,3,6,6-hexamethyldiazinane
SYSTEMATIC NAME: 1,2,3,3,6,6-hexamethyl-1,2-diazinane
MOLECULAR FORMULA: C10H22N2
MOLECULAR WEIGHT: 170.29508
SMILES: CC1(CCC(N(N1C)C)(C)C)C
Structure:
CAS RN: 60678-79-7
CAS Name: N,N-dimethyl-9-azabicyclo[3.3.1]nonan-9-amine
OPENEYE Name: N,N-dimethyl-9-azabicyclo[3.3.1]nonan-9-amine
IUPAC Name: N,N-dimethyl-9-azabicyclo[3.3.1]nonan-9-amine
SYSTEMATIC NAME: N,N-dimethyl-9-azabicyclo[3.3.1]nonan-9-amine
MOLECULAR FORMULA: C10H20N2
MOLECULAR WEIGHT: 168.2792
SMILES: CN(C)N1C2CCCC1CCC2
Structure:
CAS RN: 60678-76-4
CAS Name: N,N-dimethyl-1-azepanamine
OPENEYE Name: N,N-dimethylazepan-1-amine
IUPAC Name: N,N-dimethylazepan-1-amine
SYSTEMATIC NAME: N,N-dimethylazepan-1-amine
MOLECULAR FORMULA: C8H18N2
MOLECULAR WEIGHT: 142.24192
SMILES: CN(C)N1CCCCCC1
Structure:
CAS RN: 60678-75-3
CAS Name: 1-(1-pyrrolidinyl)azepane
OPENEYE Name: 1-pyrrolidin-1-ylazepane
IUPAC Name: 1-pyrrolidin-1-ylazepane
SYSTEMATIC NAME: 1-pyrrolidin-1-ylazepane
MOLECULAR FORMULA: C10H20N2
MOLECULAR WEIGHT: 168.2792
SMILES: C1CCCN(CC1)N2CCCC2
Structure:
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