CAS RN: 69659-06-9
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C27H42O9
MOLECULAR WEIGHT: 510.61698
SMILES: CC1CCC2(C(CC(C(C(C13C2C(=O)CC3)C)O)(C)C=C)OC(=O)CO[C@H]4[C@@H]([C@H]([C@@H](CO4)O)O)O)C
Structure:
CAS RN: 69655-80-7
CAS Name: (2R)-1,1-dichloro-2-[(1S)-2,2-dichlorocyclopropyl]oxycyclopropane
OPENEYE Name: (2R)-1,1-dichloro-2-[(1S)-2,2-dichlorocyclopropoxy]cyclopropane
IUPAC Name: (2R)-1,1-dichloro-2-[(1S)-2,2-dichlorocyclopropyl]oxycyclopropane
SYSTEMATIC NAME: (2R)-2-[(1S)-2,2-bis(chloranyl)cyclopropyl]oxy-1,1-bis(chloranyl)cyclopropane
MOLECULAR FORMULA: C6H6Cl4O
MOLECULAR WEIGHT: 235.92324
SMILES: C1[C@H](C1(Cl)Cl)O[C@H]2CC2(Cl)Cl
Structure:
CAS RN: 69640-38-6
CAS Name: 2,4-dichloro-6-(3,4,5-trichloro-1H-pyrrol-2-yl)phenol
OPENEYE Name: 2,4-dichloro-6-(3,4,5-trichloro-1H-pyrrol-2-yl)phenol
IUPAC Name: 2,4-dichloro-6-(3,4,5-trichloro-1H-pyrrol-2-yl)phenol
SYSTEMATIC NAME: 2,4-bis(chloranyl)-6-[3,4,5-tris(chloranyl)-1H-pyrrol-2-yl]phenol
MOLECULAR FORMULA: C10H4Cl5NO
MOLECULAR WEIGHT: 331.40986
SMILES: C1=C(C=C(C(=C1Cl)O)C2=C(C(=C(N2)Cl)Cl)Cl)Cl
Structure:
CAS RN: 69639-47-0
CAS Name: (3R)-N-[(3R)-1-[[(2S,3S)-2-[[(2S)-2-[[(2S,3R)-2-amino-3-methyl-1-oxopentyl]amino]-3-hydroxy-1-oxopropyl]amino]-3-hydroxy-1-oxobutyl]amino]-3-formyl-5-methyl-2-oxohexan-3-yl]-3-hydroxy-N-methyl-2-methyleneundecanamide
OPENEYE Name: (3R)-N-[(1R)-1-[2-[[(2S,3S)-2-[[(2S)-2-[[(2S,3R)-2-amino-3-methyl-pentanoyl]amino]-3-hydroxy-propanoyl]amino]-3-hydroxy-butanoyl]amino]acetyl]-1-formyl-3-methyl-butyl]-3-hydroxy-N-methyl-2-methylene-undecanamide
IUPAC Name: (3R)-N-[(3R)-1-[[(2S,3S)-2-[[(2S)-2-[[(2S,3R)-2-amino-3-methylpentanoyl]amino]-3-hydroxypropanoyl]amino]-3-hydroxybutanoyl]amino]-3-formyl-5-methyl-2-oxohexan-3-yl]-3-hydroxy-N-methyl-2-methylideneundecanamide
SYSTEMATIC NAME: (3R)-N-[(3R)-1-[[(2S,3S)-2-[[(2S)-2-[[(2S,3R)-2-azanyl-3-methyl-pentanoyl]amino]-3-oxidanyl-propanoyl]amino]-3-oxidanyl-butanoyl]amino]-3-methanoyl-5-methyl-2-oxidanylidene-hexan-3-yl]-N-methyl-2-methylidene-3-oxidanyl-undecanamide
MOLECULAR FORMULA: C34H61N5O9
MOLECULAR WEIGHT: 683.87624
SMILES: CCCCCCCC[C@H](C(=C)C(=O)N(C)[C@](CC(C)C)(C=O)C(=O)CNC(=O)[C@H]([C@H](C)O)NC(=O)[C@H](CO)NC(=O)[C@H]([C@H](C)CC)N)O
Structure:
CAS RN: 69629-21-6
CAS Name: 3-[4-(2-hydroxyethyl)phenyl]-1-cyclohex-2-enol
OPENEYE Name: 3-[4-(2-hydroxyethyl)phenyl]cyclohex-2-en-1-ol
IUPAC Name: 3-[4-(2-hydroxyethyl)phenyl]cyclohex-2-en-1-ol
SYSTEMATIC NAME: 3-[4-(2-hydroxyethyl)phenyl]cyclohex-2-en-1-ol
MOLECULAR FORMULA: C14H18O2
MOLECULAR WEIGHT: 218.29152
SMILES: C1CC(C=C(C1)C2=CC=C(C=C2)CCO)O
Structure:
CAS RN: 69629-18-1
CAS Name: 3-[4-(2-hydroxyethyl)phenyl]-1-cyclohexanone
OPENEYE Name: 3-[4-(2-hydroxyethyl)phenyl]cyclohexanone
IUPAC Name: 3-[4-(2-hydroxyethyl)phenyl]cyclohexan-1-one
SYSTEMATIC NAME: 3-[4-(2-hydroxyethyl)phenyl]cyclohexan-1-one
MOLECULAR FORMULA: C14H18O2
MOLECULAR WEIGHT: 218.29152
SMILES: C1CC(CC(=O)C1)C2=CC=C(C=C2)CCO
Structure:
CAS RN: 69629-17-0
CAS Name: (1S,3R)-3-[4-(2-hydroxyethyl)phenyl]-1-cyclohexanol
OPENEYE Name: (1S,3R)-3-[4-(2-hydroxyethyl)phenyl]cyclohexanol
IUPAC Name: (1S,3R)-3-[4-(2-hydroxyethyl)phenyl]cyclohexan-1-ol
SYSTEMATIC NAME: (1S,3R)-3-[4-(2-hydroxyethyl)phenyl]cyclohexan-1-ol
MOLECULAR FORMULA: C14H20O2
MOLECULAR WEIGHT: 220.3074
SMILES: C1C[C@H](C[C@H](C1)O)C2=CC=C(C=C2)CCO
Structure:
CAS RN: 69629-16-9
CAS Name: 3-[4-(1-hydroxypropan-2-yl)phenyl]-1-cyclohexanone
OPENEYE Name: 3-[4-(2-hydroxy-1-methyl-ethyl)phenyl]cyclohexanone
IUPAC Name: 3-[4-(1-hydroxypropan-2-yl)phenyl]cyclohexan-1-one
SYSTEMATIC NAME: 3-[4-(1-oxidanylpropan-2-yl)phenyl]cyclohexan-1-one
MOLECULAR FORMULA: C15H20O2
MOLECULAR WEIGHT: 232.3181
SMILES: CC(CO)C1=CC=C(C=C1)C2CCCC(=O)C2
Structure:
CAS RN: 69629-14-7
CAS Name: 3-[4-(2-hydroxyethyl)phenyl]-1-cyclohex-2-enone
OPENEYE Name: 3-[4-(2-hydroxyethyl)phenyl]cyclohex-2-en-1-one
IUPAC Name: 3-[4-(2-hydroxyethyl)phenyl]cyclohex-2-en-1-one
SYSTEMATIC NAME: 3-[4-(2-hydroxyethyl)phenyl]cyclohex-2-en-1-one
MOLECULAR FORMULA: C14H16O2
MOLECULAR WEIGHT: 216.27564
SMILES: C1CC(=CC(=O)C1)C2=CC=C(C=C2)CCO
Structure:
CAS RN: 69629-11-4
CAS Name: 3-[4-(1-hydroxypropan-2-yl)phenyl]-1-cyclohex-2-enone
OPENEYE Name: 3-[4-(2-hydroxy-1-methyl-ethyl)phenyl]cyclohex-2-en-1-one
IUPAC Name: 3-[4-(1-hydroxypropan-2-yl)phenyl]cyclohex-2-en-1-one
SYSTEMATIC NAME: 3-[4-(1-oxidanylpropan-2-yl)phenyl]cyclohex-2-en-1-one
MOLECULAR FORMULA: C15H18O2
MOLECULAR WEIGHT: 230.30222
SMILES: CC(CO)C1=CC=C(C=C1)C2=CC(=O)CCC2
Structure:
CAS RN: 69628-31-5
CAS Name: 11-[2-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-1-oxoethyl]-5-methyl-6-pyrido[2,3-b][1,4]benzodiazepinone
OPENEYE Name: 11-[2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]acetyl]-5-methyl-pyrido[2,3-b][1,4]benzodiazepin-6-one
IUPAC Name: 11-[2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]acetyl]-5-methylpyrido[2,3-b][1,4]benzodiazepin-6-one
SYSTEMATIC NAME: 11-[2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]ethanoyl]-5-methyl-pyrido[2,3-b][1,4]benzodiazepin-6-one
MOLECULAR FORMULA: C27H27N5O4
MOLECULAR WEIGHT: 485.53438
SMILES: CN1C2=C(N=CC=C2)N(C3=CC=CC=C3C1=O)C(=O)CN4CCN(CC4)CC5=CC6=C(C=C5)OCO6
Structure:
CAS RN: 69628-30-4
CAS Name: 11-[2-(2,4-dimethyl-1-piperazinyl)-1-oxoethyl]-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one hydrochloride
OPENEYE Name: 11-[2-(2,4-dimethylpiperazin-1-yl)acetyl]-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one hydrochloride
IUPAC Name: 11-[2-(2,4-dimethylpiperazin-1-yl)acetyl]-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one hydrochloride
SYSTEMATIC NAME: 11-[2-(2,4-dimethylpiperazin-1-yl)ethanoyl]-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one hydrochloride
MOLECULAR FORMULA: C20H24ClN5O2
MOLECULAR WEIGHT: 401.88986
SMILES: CC1CN(CCN1CC(=O)N2C3=CC=CC=C3C(=O)NC4=C2N=CC=C4)C.Cl
Structure:
CAS RN: 69628-29-1
CAS Name: 11-[2-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-1-oxoethyl]-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one
OPENEYE Name: 11-[2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]acetyl]-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one
IUPAC Name: 11-[2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]acetyl]-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one
SYSTEMATIC NAME: 11-[2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]ethanoyl]-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one
MOLECULAR FORMULA: C26H25N5O4
MOLECULAR WEIGHT: 471.5078
SMILES: C1CN(CCN1CC2=CC3=C(C=C2)OCO3)CC(=O)N4C5=CC=CC=C5C(=O)NC6=C4N=CC=C6
Structure:
CAS RN: 69628-28-0
CAS Name: 11-[2-[4-(1-adamantylmethyl)-1-piperazinyl]-1-oxoethyl]-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one
OPENEYE Name: 11-[2-[4-(1-adamantylmethyl)piperazin-1-yl]acetyl]-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one
IUPAC Name: 11-[2-[4-(1-adamantylmethyl)piperazin-1-yl]acetyl]-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one
SYSTEMATIC NAME: 11-[2-[4-(1-adamantylmethyl)piperazin-1-yl]ethanoyl]-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one
MOLECULAR FORMULA: C29H35N5O2
MOLECULAR WEIGHT: 485.6205
SMILES: C1CN(CCN1CC(=O)N2C3=CC=CC=C3C(=O)NC4=C2N=CC=C4)CC56CC7CC(C5)CC(C7)C6
Structure:
CAS RN: 69628-22-4
CAS Name: 11-[2-[4-(2,2-dimethylpropyl)-1-piperazinyl]-1-oxoethyl]-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one
OPENEYE Name: 11-[2-[4-(2,2-dimethylpropyl)piperazin-1-yl]acetyl]-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one
IUPAC Name: 11-[2-[4-(2,2-dimethylpropyl)piperazin-1-yl]acetyl]-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one
SYSTEMATIC NAME: 11-[2-[4-(2,2-dimethylpropyl)piperazin-1-yl]ethanoyl]-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one
MOLECULAR FORMULA: C23H29N5O2
MOLECULAR WEIGHT: 407.50866
SMILES: CC(C)(C)CN1CCN(CC1)CC(=O)N2C3=CC=CC=C3C(=O)NC4=C2N=CC=C4
Structure:
CAS RN: 69628-21-3
CAS Name: 11-[2-[4-(3-methylbut-2-enyl)-1-piperazinyl]-1-oxoethyl]-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one dihydrochloride
OPENEYE Name: 11-[2-[4-(3-methylbut-2-enyl)piperazin-1-yl]acetyl]-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one dihydrochloride
IUPAC Name: 11-[2-[4-(3-methylbut-2-enyl)piperazin-1-yl]acetyl]-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one dihydrochloride
SYSTEMATIC NAME: 11-[2-[4-(3-methylbut-2-enyl)piperazin-1-yl]ethanoyl]-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one dihydrochloride
MOLECULAR FORMULA: C23H29Cl2N5O2
MOLECULAR WEIGHT: 478.41466
SMILES: CC(=CCN1CCN(CC1)CC(=O)N2C3=CC=CC=C3C(=O)NC4=C2N=CC=C4)C.Cl.Cl
Structure:
CAS RN: 69628-20-2
CAS Name: 11-[2-[4-(2-methylprop-2-enyl)-1-piperazinyl]-1-oxoethyl]-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one
OPENEYE Name: 11-[2-[4-(2-methylallyl)piperazin-1-yl]acetyl]-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one
IUPAC Name: 11-[2-[4-(2-methylprop-2-enyl)piperazin-1-yl]acetyl]-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one
SYSTEMATIC NAME: 11-[2-[4-(2-methylprop-2-enyl)piperazin-1-yl]ethanoyl]-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one
MOLECULAR FORMULA: C22H25N5O2
MOLECULAR WEIGHT: 391.4662
SMILES: CC(=C)CN1CCN(CC1)CC(=O)N2C3=CC=CC=C3C(=O)NC4=C2N=CC=C4
Structure:
CAS RN: 69620-36-6
CAS Name: 2-methyl-1-[4-(methylthio)phenyl]-3-(1-pyrrolidinyl)-1-propanone hydrochloride
OPENEYE Name: 2-methyl-1-(4-methylsulfanylphenyl)-3-pyrrolidin-1-yl-propan-1-one hydrochloride
IUPAC Name: 2-methyl-1-(4-methylsulfanylphenyl)-3-pyrrolidin-1-ylpropan-1-one hydrochloride
SYSTEMATIC NAME: 2-methyl-1-(4-methylsulfanylphenyl)-3-pyrrolidin-1-yl-propan-1-one hydrochloride
MOLECULAR FORMULA: C15H22ClNOS
MOLECULAR WEIGHT: 299.85928
SMILES: CC(CN1CCCC1)C(=O)C2=CC=C(C=C2)SC.Cl
Structure:
CAS RN: 69620-22-0
CAS Name: 3-(2,5-dioxo-1-pyrrolidinyl)-1-(2-methylphenyl)pyrrolidine-2,5-dione
OPENEYE Name: 3-(2,5-dioxopyrrolidin-1-yl)-1-(o-tolyl)pyrrolidine-2,5-dione
IUPAC Name: 3-(2,5-dioxopyrrolidin-1-yl)-1-(2-methylphenyl)pyrrolidine-2,5-dione
SYSTEMATIC NAME: 3-[2,5-bis(oxidanylidene)pyrrolidin-1-yl]-1-(2-methylphenyl)pyrrolidine-2,5-dione
MOLECULAR FORMULA: C15H14N2O4
MOLECULAR WEIGHT: 286.28266
SMILES: CC1=CC=CC=C1N2C(=O)CC(C2=O)N3C(=O)CCC3=O
Structure:
CAS RN: 69610-48-6
CAS Name: acetic acid [(3R,4R,5R,6R)-4,5-diacetyloxy-6-[[[methyl(nitroso)amino]-oxomethyl]amino]-3-oxanyl] ester
OPENEYE Name: [(3R,4R,5R,6R)-4,5-diacetoxy-6-[[methyl(nitroso)carbamoyl]amino]tetrahydropyran-3-yl] acetate
IUPAC Name: [(3R,4R,5R,6R)-4,5-diacetyloxy-6-[[methyl(nitroso)carbamoyl]amino]oxan-3-yl] acetate
SYSTEMATIC NAME: [(3R,4R,5R,6R)-4,5-diacetyloxy-6-[[methyl(nitroso)carbamoyl]amino]oxan-3-yl] ethanoate
MOLECULAR FORMULA: C13H19N3O9
MOLECULAR WEIGHT: 361.30466
SMILES: CC(=O)O[C@@H]1CO[C@H]([C@@H]([C@@H]1OC(=O)C)OC(=O)C)NC(=O)N(C)N=O
Structure:
CAS RN: 69602-09-1
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C14H17N3
MOLECULAR WEIGHT: 227.30488
SMILES: C1CN2CCC1C3=NC4=CC=CC=C4NCC32
Structure:
CAS RN: 69602-08-0
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C14H19N3
MOLECULAR WEIGHT: 229.32076
SMILES: C1CN2CCC1C3C2CNC4=CC=CC=C4N3
Structure:
CAS RN: 69597-49-5
CAS Name: propanoic acid [1,2-dimethyl-3-(2-methylphenyl)-3-pyrrolidinyl] ester
OPENEYE Name: [1,2-dimethyl-3-(o-tolyl)pyrrolidin-3-yl] propanoate
IUPAC Name: [1,2-dimethyl-3-(2-methylphenyl)pyrrolidin-3-yl] propanoate
SYSTEMATIC NAME: [1,2-dimethyl-3-(2-methylphenyl)pyrrolidin-3-yl] propanoate
MOLECULAR FORMULA: C16H23NO2
MOLECULAR WEIGHT: 261.35932
SMILES: CCC(=O)OC1(CCN(C1C)C)C2=CC=CC=C2C
Structure:
CAS RN: 69591-43-1
CAS Name: 11-[1-oxo-3-[4-(phenylmethyl)-1-piperazinyl]propyl]-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one
OPENEYE Name: 11-[3-(4-benzylpiperazin-1-yl)propanoyl]-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one
IUPAC Name: 11-[3-(4-benzylpiperazin-1-yl)propanoyl]-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one
SYSTEMATIC NAME: 11-[3-[4-(phenylmethyl)piperazin-1-yl]propanoyl]-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one
MOLECULAR FORMULA: C26H27N5O2
MOLECULAR WEIGHT: 441.52488
SMILES: C1CN(CCN1CCC(=O)N2C3=CC=CC=C3C(=O)NC4=C2N=CC=C4)CC5=CC=CC=C5
Structure:
CAS RN: 69584-57-2
CAS Name: N,N-dimethyl-3-(6,7,8,9-tetrahydropyrido[3,2-b]azepin-5-yl)-1-propanamine dihydrochloride
OPENEYE Name: N,N-dimethyl-3-(6,7,8,9-tetrahydropyrido[3,2-b]azepin-5-yl)propan-1-amine dihydrochloride
IUPAC Name: N,N-dimethyl-3-(6,7,8,9-tetrahydropyrido[3,2-b]azepin-5-yl)propan-1-amine dihydrochloride
SYSTEMATIC NAME: N,N-dimethyl-3-(6,7,8,9-tetrahydropyrido[3,2-b]azepin-5-yl)propan-1-amine dihydrochloride
MOLECULAR FORMULA: C14H25Cl2N3
MOLECULAR WEIGHT: 306.2744
SMILES: CN(C)CCCN1CCCCC2=C1C=CC=N2.Cl.Cl
Structure:
CAS RN: 69584-54-9
CAS Name: 4-nitrobenzoic acid [(6R)-2,2-dimethyl-4-[[[methyl(nitroso)amino]-oxomethyl]amino]-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methyl ester
OPENEYE Name: [(6R)-2,2-dimethyl-4-[[methyl(nitroso)carbamoyl]amino]-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methyl 4-nitrobenzoate
IUPAC Name: [(6R)-2,2-dimethyl-4-[[methyl(nitroso)carbamoyl]amino]-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methyl 4-nitrobenzoate
SYSTEMATIC NAME: [(6R)-2,2-dimethyl-4-[[methyl(nitroso)carbamoyl]amino]-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methyl 4-nitrobenzoate
MOLECULAR FORMULA: C17H20N4O9
MOLECULAR WEIGHT: 424.3621
SMILES: CC1(OC2[C@H](OC(C2O1)NC(=O)N(C)N=O)COC(=O)C3=CC=C(C=C3)[N+](=O)[O-])C
Structure:
CAS RN: 69578-74-1
CAS Name: N-(cyclohexylideneamino)-6-(4-morpholinyl)-3-pyridazinamine
OPENEYE Name: N-(cyclohexylideneamino)-6-morpholino-pyridazin-3-amine
IUPAC Name: N-(cyclohexylideneamino)-6-morpholin-4-ylpyridazin-3-amine
SYSTEMATIC NAME: N-(cyclohexylideneamino)-6-morpholin-4-yl-pyridazin-3-amine
MOLECULAR FORMULA: C14H21N5O
MOLECULAR WEIGHT: 275.34944
SMILES: C1CCC(=NNC2=NN=C(C=C2)N3CCOCC3)CC1
Structure:
CAS RN: 69578-68-3
CAS Name: N-[(4,7,7-trimethyl-3-bicyclo[2.2.1]heptanylidene)amino]-3-pyridazinamine
OPENEYE Name: N-[(1,7,7-trimethylnorbornan-2-ylidene)amino]pyridazin-3-amine
IUPAC Name: N-[(4,7,7-trimethyl-3-bicyclo[2.2.1]heptanylidene)amino]pyridazin-3-amine
SYSTEMATIC NAME: N-[(4,7,7-trimethyl-3-bicyclo[2.2.1]heptanylidene)amino]pyridazin-3-amine
MOLECULAR FORMULA: C14H20N4
MOLECULAR WEIGHT: 244.3354
SMILES: CC1(C2CCC1(C(=NNC3=NN=CC=C3)C2)C)C
Structure:
CAS RN: 69570-86-1
CAS Name: 4-(hydroxymethyl)-2-methyl-5-[[4-[6-methyl-2-(1-piperidinyl)-4-pyrimidinyl]-1-piperazinyl]methyl]-3-pyridinol
OPENEYE Name: 4-(hydroxymethyl)-2-methyl-5-[[4-[6-methyl-2-(1-piperidyl)pyrimidin-4-yl]piperazin-1-yl]methyl]pyridin-3-ol
IUPAC Name: 4-(hydroxymethyl)-2-methyl-5-[[4-(6-methyl-2-piperidin-1-ylpyrimidin-4-yl)piperazin-1-yl]methyl]pyridin-3-ol
SYSTEMATIC NAME: 4-(hydroxymethyl)-2-methyl-5-[[4-(6-methyl-2-piperidin-1-yl-pyrimidin-4-yl)piperazin-1-yl]methyl]pyridin-3-ol
MOLECULAR FORMULA: C22H32N6O2
MOLECULAR WEIGHT: 412.52848
SMILES: CC1=CC(=NC(=N1)N2CCCCC2)N3CCN(CC3)CC4=CN=C(C(=C4CO)O)C
Structure:
CAS RN: 69570-85-0
CAS Name: 5-[7-[2-[7-[5-hydroxy-4-(hydroxymethyl)-6-methyl-3-pyridinyl]-1,4-diazabicyclo[2.2.1]heptan-7-yl]-6-methyl-4-pyrimidinyl]-1,4-diazabicyclo[2.2.1]heptan-7-yl]-4-(hydroxymethyl)-2-methyl-3-pyridinol
OPENEYE Name: 5-[7-[2-[7-[5-hydroxy-4-(hydroxymethyl)-6-methyl-3-pyridyl]-1,4-diazabicyclo[2.2.1]heptan-7-yl]-6-methyl-pyrimidin-4-yl]-1,4-diazabicyclo[2.2.1]heptan-7-yl]-4-(hydroxymethyl)-2-methyl-pyridin-3-ol
IUPAC Name: 5-[7-[2-[7-[5-hydroxy-4-(hydroxymethyl)-6-methylpyridin-3-yl]-1,4-diazabicyclo[2.2.1]heptan-7-yl]-6-methylpyrimidin-4-yl]-1,4-diazabicyclo[2.2.1]heptan-7-yl]-4-(hydroxymethyl)-2-methylpyridin-3-ol
SYSTEMATIC NAME: 4-(hydroxymethyl)-5-[7-[2-[7-[4-(hydroxymethyl)-6-methyl-5-oxidanyl-pyridin-3-yl]-1,4-diazabicyclo[2.2.1]heptan-7-yl]-6-methyl-pyrimidin-4-yl]-1,4-diazabicyclo[2.2.1]heptan-7-yl]-2-methyl-pyridin-3-ol
MOLECULAR FORMULA: C29H36N8O4
MOLECULAR WEIGHT: 560.64734
SMILES: CC1=NC(=NC(=C1)C2(N3CCN2CC3)C4=CN=C(C(=C4CO)O)C)C5(N6CCN5CC6)C7=CN=C(C(=C7CO)O)C
Structure:
CAS RN: 69570-09-8
CAS Name: 5,6-bis(4-methoxyphenyl)-2-methyl-1,2,4-triazine-3-thione
OPENEYE Name: 5,6-bis(4-methoxyphenyl)-2-methyl-1,2,4-triazine-3-thione
IUPAC Name: 5,6-bis(4-methoxyphenyl)-2-methyl-1,2,4-triazine-3-thione
SYSTEMATIC NAME: 5,6-bis(4-methoxyphenyl)-2-methyl-1,2,4-triazine-3-thione
MOLECULAR FORMULA: C18H17N3O2S
MOLECULAR WEIGHT: 339.41148
SMILES: CN1C(=S)N=C(C(=N1)C2=CC=C(C=C2)OC)C3=CC=C(C=C3)OC
Structure:
CAS RN: 2055-12-1
CAS Name: 2-methyl-3-(2-piperidinyl)pyridine
OPENEYE Name: 2-methyl-3-(2-piperidyl)pyridine
IUPAC Name: 2-methyl-3-piperidin-2-ylpyridine
SYSTEMATIC NAME: 2-methyl-3-piperidin-2-yl-pyridine
MOLECULAR FORMULA: C11H16N2
MOLECULAR WEIGHT: 176.25814
SMILES: CC1=C(C=CC=N1)C2CCCCN2
Structure:
CAS RN: 69567-20-0
CAS Name: 2-methyl-3-(2-piperidinyl)pyridine
OPENEYE Name: 2-methyl-3-(2-piperidyl)pyridine
IUPAC Name: 2-methyl-3-piperidin-2-ylpyridine
SYSTEMATIC NAME: 2-methyl-3-piperidin-2-yl-pyridine
MOLECULAR FORMULA: C11H16N2
MOLECULAR WEIGHT: 176.25814
SMILES: CC1=C(C=CC=N1)C2CCCCN2
Structure:
CAS RN: 69567-19-7
CAS Name: 2,6-dimethyl-3-(1-methyl-2-pyrrolidinyl)pyridine
OPENEYE Name: 2,6-dimethyl-3-(1-methylpyrrolidin-2-yl)pyridine
IUPAC Name: 2,6-dimethyl-3-(1-methylpyrrolidin-2-yl)pyridine
SYSTEMATIC NAME: 2,6-dimethyl-3-(1-methylpyrrolidin-2-yl)pyridine
MOLECULAR FORMULA: C12H18N2
MOLECULAR WEIGHT: 190.28472
SMILES: CC1=NC(=C(C=C1)C2CCCN2C)C
Structure:
CAS RN: 69567-18-6
CAS Name: 2-methyl-3-(2-pyrrolidinyl)pyridine
OPENEYE Name: 2-methyl-3-pyrrolidin-2-yl-pyridine
IUPAC Name: 2-methyl-3-pyrrolidin-2-ylpyridine
SYSTEMATIC NAME: 2-methyl-3-pyrrolidin-2-yl-pyridine
MOLECULAR FORMULA: C10H14N2
MOLECULAR WEIGHT: 162.23156
SMILES: CC1=C(C=CC=N1)C2CCCN2
Structure:
CAS RN: 69566-89-8
CAS Name: 3-(dimethylamino)-1-[4-(ethylthio)phenyl]-2-methyl-1-propanone hydrochloride
OPENEYE Name: 3-(dimethylamino)-1-(4-ethylsulfanylphenyl)-2-methyl-propan-1-one hydrochloride
IUPAC Name: 3-(dimethylamino)-1-(4-ethylsulfanylphenyl)-2-methylpropan-1-one hydrochloride
SYSTEMATIC NAME: 3-(dimethylamino)-1-(4-ethylsulfanylphenyl)-2-methyl-propan-1-one hydrochloride
MOLECULAR FORMULA: C14H22ClNOS
MOLECULAR WEIGHT: 287.84858
SMILES: CCSC1=CC=C(C=C1)C(=O)C(C)CN(C)C.Cl
Structure:
CAS RN: 69566-88-7
CAS Name: 2-methyl-3-(4-methyl-1-piperazinyl)-1-[4-(methylthio)phenyl]-1-propanone hydrochloride
OPENEYE Name: 2-methyl-3-(4-methylpiperazin-1-yl)-1-(4-methylsulfanylphenyl)propan-1-one hydrochloride
IUPAC Name: 2-methyl-3-(4-methylpiperazin-1-yl)-1-(4-methylsulfanylphenyl)propan-1-one hydrochloride
SYSTEMATIC NAME: 2-methyl-3-(4-methylpiperazin-1-yl)-1-(4-methylsulfanylphenyl)propan-1-one hydrochloride
MOLECULAR FORMULA: C16H25ClN2OS
MOLECULAR WEIGHT: 328.9005
SMILES: CC(CN1CCN(CC1)C)C(=O)C2=CC=C(C=C2)SC.Cl
Structure:
CAS RN: 69566-86-5
CAS Name: 2-methyl-1-[4-(methylthio)phenyl]-3-(1-piperidinyl)-1-propanone hydrochloride
OPENEYE Name: 2-methyl-1-(4-methylsulfanylphenyl)-3-(1-piperidyl)propan-1-one hydrochloride
IUPAC Name: 2-methyl-1-(4-methylsulfanylphenyl)-3-piperidin-1-ylpropan-1-one hydrochloride
SYSTEMATIC NAME: 2-methyl-1-(4-methylsulfanylphenyl)-3-piperidin-1-yl-propan-1-one hydrochloride
MOLECULAR FORMULA: C16H24ClNOS
MOLECULAR WEIGHT: 313.88586
SMILES: CC(CN1CCCCC1)C(=O)C2=CC=C(C=C2)SC.Cl
Structure:
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