CAS RN: 84500-68-5
CAS Name: 1-(1,2,3,4-tetrahydroisoquinolin-1-yl)-1,2,3,4-tetrahydroisoquinoline
OPENEYE Name: 1-(1,2,3,4-tetrahydroisoquinolin-1-yl)-1,2,3,4-tetrahydroisoquinoline
IUPAC Name: 1-(1,2,3,4-tetrahydroisoquinolin-1-yl)-1,2,3,4-tetrahydroisoquinoline
SYSTEMATIC NAME: 1-(1,2,3,4-tetrahydroisoquinolin-1-yl)-1,2,3,4-tetrahydroisoquinoline
MOLECULAR FORMULA: C18H20N2
MOLECULAR WEIGHT: 264.3648
SMILES: C1CNC(C2=CC=CC=C21)C3C4=CC=CC=C4CCN3
Structure:
CAS RN: 5832-54-2
CAS Name: 2-methylene-1-azabicyclo[2.2.2]octan-3-one
OPENEYE Name: 2-methylenequinuclidin-3-one
IUPAC Name: 2-methylidene-1-azabicyclo[2.2.2]octan-3-one
SYSTEMATIC NAME: 2-methylidene-1-azabicyclo[2.2.2]octan-3-one
MOLECULAR FORMULA: C8H11NO
MOLECULAR WEIGHT: 137.17904
SMILES: C=C1C(=O)C2CCN1CC2
Structure:
CAS RN: 65541-32-4
CAS Name: 2-methylene-1-azabicyclo[2.2.2]octan-3-one; 2,4,6-trinitrophenol
OPENEYE Name: 2-methylenequinuclidin-3-one; picric acid
IUPAC Name: 2-methylidene-1-azabicyclo[2.2.2]octan-3-one; 2,4,6-trinitrophenol
SYSTEMATIC NAME: 2-methylidene-1-azabicyclo[2.2.2]octan-3-one; 2,4,6-trinitrophenol
MOLECULAR FORMULA: C14H14N4O8
MOLECULAR WEIGHT: 366.28296
SMILES: C=C1C(=O)C2CCN1CC2.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]
Structure:
CAS RN: 5291-31-6
CAS Name: 2,2-bis(hydroxymethyl)-1-azabicyclo[2.2.2]octan-3-ol
OPENEYE Name: 2,2-bis(hydroxymethyl)quinuclidin-3-ol
IUPAC Name: 2,2-bis(hydroxymethyl)-1-azabicyclo[2.2.2]octan-3-ol
SYSTEMATIC NAME: 2,2-bis(hydroxymethyl)-1-azabicyclo[2.2.2]octan-3-ol
MOLECULAR FORMULA: C9H17NO3
MOLECULAR WEIGHT: 187.23618
SMILES: C1CN2CCC1C(C2(CO)CO)O
Structure:
CAS RN: 5608-24-2
CAS Name: 2,2-bis(hydroxymethyl)-1-azabicyclo[2.2.2]octan-3-one
OPENEYE Name: 2,2-bis(hydroxymethyl)quinuclidin-3-one
IUPAC Name: 2,2-bis(hydroxymethyl)-1-azabicyclo[2.2.2]octan-3-one
SYSTEMATIC NAME: 2,2-bis(hydroxymethyl)-1-azabicyclo[2.2.2]octan-3-one
MOLECULAR FORMULA: C9H15NO3
MOLECULAR WEIGHT: 185.2203
SMILES: C1CN2CCC1C(=O)C2(CO)CO
Structure:
CAS RN: 6125-25-3
CAS Name: 4-methylbenzenesulfonic acid [3-[(4-methylphenyl)sulfonyloxymethyl]-3-oxetanyl]methyl ester
OPENEYE Name: [3-(p-tolylsulfonyloxymethyl)oxetan-3-yl]methyl 4-methylbenzenesulfonate
IUPAC Name: [3-[(4-methylphenyl)sulfonyloxymethyl]oxetan-3-yl]methyl 4-methylbenzenesulfonate
SYSTEMATIC NAME: [3-[(4-methylphenyl)sulfonyloxymethyl]oxetan-3-yl]methyl 4-methylbenzenesulfonate
MOLECULAR FORMULA: C19H22O7S2
MOLECULAR WEIGHT: 426.50378
SMILES: CC1=CC=C(C=C1)S(=O)(=O)OCC2(COC2)COS(=O)(=O)C3=CC=C(C=C3)C
Structure:
CAS RN: 89181-72-6
CAS Name: nitric acid [3-(nitrooxymethyl)-3-oxetanyl]methyl ester
OPENEYE Name: [3-(nitrooxymethyl)oxetan-3-yl]methyl nitrate
IUPAC Name: [3-(nitrooxymethyl)oxetan-3-yl]methyl nitrate
SYSTEMATIC NAME: [3-(nitrooxymethyl)oxetan-3-yl]methyl nitrate
MOLECULAR FORMULA: C5H8N2O7
MOLECULAR WEIGHT: 208.12622
SMILES: C1C(CO1)(CO[N+](=O)[O-])CO[N+](=O)[O-]
Structure:
CAS RN: 14164-70-6
CAS Name: 1-(4-hydroxy-3-methyl-2,6-diphenylcyclohexyl)-2-methyl-3-phenyl-2-propen-1-one
OPENEYE Name: 1-(4-hydroxy-3-methyl-2,6-diphenyl-cyclohexyl)-2-methyl-3-phenyl-prop-2-en-1-one
IUPAC Name: 1-(4-hydroxy-3-methyl-2,6-diphenylcyclohexyl)-2-methyl-3-phenylprop-2-en-1-one
SYSTEMATIC NAME: 2-methyl-1-(3-methyl-4-oxidanyl-2,6-diphenyl-cyclohexyl)-3-phenyl-prop-2-en-1-one
MOLECULAR FORMULA: C29H30O2
MOLECULAR WEIGHT: 410.5473
SMILES: CC1C(CC(C(C1C2=CC=CC=C2)C(=O)C(=CC3=CC=CC=C3)C)C4=CC=CC=C4)O
Structure:
CAS RN: 16831-04-2
CAS Name: 1-(2-methoxyphenyl)-2-methyl-1-penten-3-one
OPENEYE Name: 1-(2-methoxyphenyl)-2-methyl-pent-1-en-3-one
IUPAC Name: 1-(2-methoxyphenyl)-2-methylpent-1-en-3-one
SYSTEMATIC NAME: 1-(2-methoxyphenyl)-2-methyl-pent-1-en-3-one
MOLECULAR FORMULA: C13H16O2
MOLECULAR WEIGHT: 204.26494
SMILES: CCC(=O)C(=CC1=CC=CC=C1OC)C
Structure:
CAS RN: 16831-05-3
CAS Name: 4-(2,4-dimethoxyphenyl)-3-buten-2-one
OPENEYE Name: 4-(2,4-dimethoxyphenyl)but-3-en-2-one
IUPAC Name: 4-(2,4-dimethoxyphenyl)but-3-en-2-one
SYSTEMATIC NAME: 4-(2,4-dimethoxyphenyl)but-3-en-2-one
MOLECULAR FORMULA: C12H14O3
MOLECULAR WEIGHT: 206.23776
SMILES: CC(=O)C=CC1=C(C=C(C=C1)OC)OC
Structure:
CAS RN: 29166-21-0
CAS Name: 1-[4-(dimethylamino)phenyl]-1-penten-3-one
OPENEYE Name: 1-[4-(dimethylamino)phenyl]pent-1-en-3-one
IUPAC Name: 1-[4-(dimethylamino)phenyl]pent-1-en-3-one
SYSTEMATIC NAME: 1-[4-(dimethylamino)phenyl]pent-1-en-3-one
MOLECULAR FORMULA: C13H17NO
MOLECULAR WEIGHT: 203.28018
SMILES: CCC(=O)C=CC1=CC=C(C=C1)N(C)C
Structure:
CAS RN: 37098-43-4
CAS Name: 3,6-dinitrocyclohexane-1,2,4,5-tetrol
OPENEYE Name: 3,6-dinitrocyclohexane-1,2,4,5-tetrol
IUPAC Name: 3,6-dinitrocyclohexane-1,2,4,5-tetrol
SYSTEMATIC NAME: 3,6-dinitrocyclohexane-1,2,4,5-tetrol
MOLECULAR FORMULA: C6H10N2O8
MOLECULAR WEIGHT: 238.1522
SMILES: C1(C(C(C(C(C1O)O)[N+](=O)[O-])O)O)[N+](=O)[O-]
Structure:
CAS RN: 42351-81-5
CAS Name: 2,2-diethoxyethylhydrazine
OPENEYE Name: 2,2-diethoxyethylhydrazine
IUPAC Name: 2,2-diethoxyethylhydrazine
SYSTEMATIC NAME: 2,2-diethoxyethyldiazane
MOLECULAR FORMULA: C6H16N2O2
MOLECULAR WEIGHT: 148.20344
SMILES: CCOC(CNN)OCC
Structure:
CAS RN: 59461-66-4
CAS Name: 4-methylbenzenesulfonic acid [2-[(4-methylphenyl)sulfonyloxymethyl]cyclohexyl]methyl ester
OPENEYE Name: [2-(p-tolylsulfonyloxymethyl)cyclohexyl]methyl 4-methylbenzenesulfonate
IUPAC Name: [2-[(4-methylphenyl)sulfonyloxymethyl]cyclohexyl]methyl 4-methylbenzenesulfonate
SYSTEMATIC NAME: [2-[(4-methylphenyl)sulfonyloxymethyl]cyclohexyl]methyl 4-methylbenzenesulfonate
MOLECULAR FORMULA: C22H28O6S2
MOLECULAR WEIGHT: 452.58412
SMILES: CC1=CC=C(C=C1)S(=O)(=O)OCC2CCCCC2COS(=O)(=O)C3=CC=C(C=C3)C
Structure:
CAS RN: 62208-94-0
CAS Name: 4-methylbenzenesulfonic acid [2-[(4-methylphenyl)sulfonyloxymethyl]cyclohexyl]methyl ester
OPENEYE Name: [2-(p-tolylsulfonyloxymethyl)cyclohexyl]methyl 4-methylbenzenesulfonate
IUPAC Name: [2-[(4-methylphenyl)sulfonyloxymethyl]cyclohexyl]methyl 4-methylbenzenesulfonate
SYSTEMATIC NAME: [2-[(4-methylphenyl)sulfonyloxymethyl]cyclohexyl]methyl 4-methylbenzenesulfonate
MOLECULAR FORMULA: C22H28O6S2
MOLECULAR WEIGHT: 452.58412
SMILES: CC1=CC=C(C=C1)S(=O)(=O)OCC2CCCCC2COS(=O)(=O)C3=CC=C(C=C3)C
Structure:
CAS RN: 31166-90-2
CAS Name: 2-hydroxyimino-3-phenyl-3,5,6,7-tetrahydrobenzofuran-4-one
OPENEYE Name: 2-hydroxyimino-3-phenyl-3,5,6,7-tetrahydrobenzofuran-4-one
IUPAC Name: 2-hydroxyimino-3-phenyl-3,5,6,7-tetrahydro-1-benzofuran-4-one
SYSTEMATIC NAME: 2-hydroxyimino-3-phenyl-3,5,6,7-tetrahydro-1-benzofuran-4-one
MOLECULAR FORMULA: C14H13NO3
MOLECULAR WEIGHT: 243.25792
SMILES: C1CC2=C(C(C(=NO)O2)C3=CC=CC=C3)C(=O)C1
Structure:
CAS RN: 58979-86-5
CAS Name: 2-(5-oxo-1,2-dihydropyrazol-3-yl)acetohydrazide
OPENEYE Name: 2-(5-oxo-1,2-dihydropyrazol-3-yl)acetohydrazide
IUPAC Name: 2-(5-oxo-1,2-dihydropyrazol-3-yl)acetohydrazide
SYSTEMATIC NAME: 2-(5-oxidanylidene-1,2-dihydropyrazol-3-yl)ethanehydrazide
MOLECULAR FORMULA: C5H8N4O2
MOLECULAR WEIGHT: 156.14262
SMILES: C1=C(NNC1=O)CC(=O)NN
Structure:
CAS RN: 2206-60-2
CAS Name: 2,5-dinitrohexane-1,6-diol
OPENEYE Name: 2,5-dinitrohexane-1,6-diol
IUPAC Name: 2,5-dinitrohexane-1,6-diol
SYSTEMATIC NAME: 2,5-dinitrohexane-1,6-diol
MOLECULAR FORMULA: C6H12N2O6
MOLECULAR WEIGHT: 208.16928
SMILES: C(CC(CO)[N+](=O)[O-])C(CO)[N+](=O)[O-]
Structure:
CAS RN: 62178-12-5
CAS Name: 4-[2-(4-propoxyphenyl)-4-thiazolyl]aniline
OPENEYE Name: 4-[2-(4-propoxyphenyl)thiazol-4-yl]aniline
IUPAC Name: 4-[2-(4-propoxyphenyl)-1,3-thiazol-4-yl]aniline
SYSTEMATIC NAME: 4-[2-(4-propoxyphenyl)-1,3-thiazol-4-yl]aniline
MOLECULAR FORMULA: C18H18N2OS
MOLECULAR WEIGHT: 310.41332
SMILES: CCCOC1=CC=C(C=C1)C2=NC(=CS2)C3=CC=C(C=C3)N
Structure:
CAS RN: 60758-84-1
CAS Name: 4-propoxybenzonitrile
OPENEYE Name: 4-propoxybenzonitrile
IUPAC Name: 4-propoxybenzonitrile
SYSTEMATIC NAME: 4-propoxybenzenecarbonitrile
MOLECULAR FORMULA: C10H11NO
MOLECULAR WEIGHT: 161.20044
SMILES: CCCOC1=CC=C(C=C1)C#N
Structure:
CAS RN: 25021-66-3
CAS Name: 1-(4-aminophenyl)-2-chloro-1-propanone
OPENEYE Name: 1-(4-aminophenyl)-2-chloro-propan-1-one
IUPAC Name: 1-(4-aminophenyl)-2-chloropropan-1-one
SYSTEMATIC NAME: 1-(4-aminophenyl)-2-chloranyl-propan-1-one
MOLECULAR FORMULA: C9H10ClNO
MOLECULAR WEIGHT: 183.6348
SMILES: CC(C(=O)C1=CC=C(C=C1)N)Cl
Structure:
CAS RN: 81112-08-5
CAS Name: N-[4-(2-chloro-1-oxopropyl)phenyl]acetamide
OPENEYE Name: N-[4-(2-chloropropanoyl)phenyl]acetamide
IUPAC Name: N-[4-(2-chloropropanoyl)phenyl]acetamide
SYSTEMATIC NAME: N-[4-(2-chloranylpropanoyl)phenyl]ethanamide
MOLECULAR FORMULA: C11H12ClNO2
MOLECULAR WEIGHT: 225.67148
SMILES: CC(C(=O)C1=CC=C(C=C1)NC(=O)C)Cl
Structure:
CAS RN: 56967-08-9
CAS Name: methanesulfonic acid 2-[4-formyl-3-methyl-N-(2-methylsulfonyloxyethyl)anilino]ethyl ester
OPENEYE Name: 2-[4-formyl-3-methyl-N-(2-methylsulfonyloxyethyl)anilino]ethyl methanesulfonate
IUPAC Name: 2-[4-formyl-3-methyl-N-(2-methylsulfonyloxyethyl)anilino]ethyl methanesulfonate
SYSTEMATIC NAME: 2-[(4-methanoyl-3-methyl-phenyl)-(2-methylsulfonyloxyethyl)amino]ethyl methanesulfonate
MOLECULAR FORMULA: C14H21NO7S2
MOLECULAR WEIGHT: 379.44904
SMILES: CC1=C(C=CC(=C1)N(CCOS(=O)(=O)C)CCOS(=O)(=O)C)C=O
Structure:
CAS RN: 90798-26-8
CAS Name: N-[3-chloro-4-(2-chloro-1-oxoethyl)phenyl]acetamide
OPENEYE Name: N-[3-chloro-4-(2-chloroacetyl)phenyl]acetamide
IUPAC Name: N-[3-chloro-4-(2-chloroacetyl)phenyl]acetamide
SYSTEMATIC NAME: N-[3-chloranyl-4-(2-chloranylethanoyl)phenyl]ethanamide
MOLECULAR FORMULA: C10H9Cl2NO2
MOLECULAR WEIGHT: 246.08996
SMILES: CC(=O)NC1=CC(=C(C=C1)C(=O)CCl)Cl
Structure:
CAS RN: 55211-13-7
CAS Name: 3-[6-[4-(3-chlorophenyl)-1-piperazinyl]hexyl]-1H-quinazoline-2,4-dione
OPENEYE Name: 3-[6-[4-(3-chlorophenyl)piperazin-1-yl]hexyl]-1H-quinazoline-2,4-dione
IUPAC Name: 3-[6-[4-(3-chlorophenyl)piperazin-1-yl]hexyl]-1H-quinazoline-2,4-dione
SYSTEMATIC NAME: 3-[6-[4-(3-chlorophenyl)piperazin-1-yl]hexyl]-1H-quinazoline-2,4-dione
MOLECULAR FORMULA: C24H29ClN4O2
MOLECULAR WEIGHT: 440.96566
SMILES: C1CN(CCN1CCCCCCN2C(=O)C3=CC=CC=C3NC2=O)C4=CC(=CC=C4)Cl
Structure:
CAS RN: 59571-95-8
CAS Name: 2,3,10,11-tetramethoxy-5-methyl-13-(methylsulfinylmethyl)-7,8,13,14-tetrahydro-6H-benzo[e][1]benzazecine
OPENEYE Name: 2,3,10,11-tetramethoxy-5-methyl-13-(methylsulfinylmethyl)-7,8,13,14-tetrahydro-6H-benzo[e][1]benzazecine
IUPAC Name: 2,3,10,11-tetramethoxy-5-methyl-13-(methylsulfinylmethyl)-7,8,13,14-tetrahydro-6H-benzo[e][1]benzazecine
SYSTEMATIC NAME: 2,3,10,11-tetramethoxy-5-methyl-13-(methylsulfinylmethyl)-7,8,13,14-tetrahydro-6H-benzo[e][1]benzazecine
MOLECULAR FORMULA: C24H33NO5S
MOLECULAR WEIGHT: 447.58752
SMILES: CN1CCCC2=CC(=C(C=C2C(CC3=CC(=C(C=C31)OC)OC)CS(=O)C)OC)OC
Structure:
CAS RN: 59572-01-9
CAS Name: 2,3,10-trimethoxy-5-methyl-13-[(methylthio)methyl]-7,8,13,14-tetrahydro-6H-benzo[e][1]benzazecin-11-ol
OPENEYE Name: 2,3,10-trimethoxy-5-methyl-13-(methylsulfanylmethyl)-7,8,13,14-tetrahydro-6H-benzo[e][1]benzazecin-11-ol
IUPAC Name: 2,3,10-trimethoxy-5-methyl-13-(methylsulfanylmethyl)-7,8,13,14-tetrahydro-6H-benzo[e][1]benzazecin-11-ol
SYSTEMATIC NAME: 2,3,10-trimethoxy-5-methyl-13-(methylsulfanylmethyl)-7,8,13,14-tetrahydro-6H-benzo[e][1]benzazecin-11-ol
MOLECULAR FORMULA: C23H31NO4S
MOLECULAR WEIGHT: 417.56154
SMILES: CN1CCCC2=CC(=C(C=C2C(CC3=CC(=C(C=C31)OC)OC)CSC)O)OC
Structure:
CAS RN: 59571-97-0
CAS Name: 2,3,10,11-tetramethoxy-5-methyl-13-[(methylthio)methyl]-7,8,13,14-tetrahydro-6H-benzo[e][1]benzazecine
OPENEYE Name: 2,3,10,11-tetramethoxy-5-methyl-13-(methylsulfanylmethyl)-7,8,13,14-tetrahydro-6H-benzo[e][1]benzazecine
IUPAC Name: 2,3,10,11-tetramethoxy-5-methyl-13-(methylsulfanylmethyl)-7,8,13,14-tetrahydro-6H-benzo[e][1]benzazecine
SYSTEMATIC NAME: 2,3,10,11-tetramethoxy-5-methyl-13-(methylsulfanylmethyl)-7,8,13,14-tetrahydro-6H-benzo[e][1]benzazecine
MOLECULAR FORMULA: C24H33NO4S
MOLECULAR WEIGHT: 431.58812
SMILES: CN1CCCC2=CC(=C(C=C2C(CC3=CC(=C(C=C31)OC)OC)CSC)OC)OC
Structure:
CAS RN: 58939-39-2
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C21H25NO4S
MOLECULAR WEIGHT: 387.4925
SMILES: CN1CCC2=CC(=C(C=C2C(CC3=CC4=C(C=C31)OCO4)CSC)O)OC
Structure:
CAS RN: 70374-15-1
CAS Name: 3,3'-spirobi[2,4-dihydro-[1,3]thiazino[3,2-a]benzimidazole]
OPENEYE Name: 3,3'-spirobi[2,4-dihydro-[1,3]thiazino[3,2-a]benzimidazole]
IUPAC Name: 3,3'-spirobi[2,4-dihydro-[1,3]thiazino[3,2-a]benzimidazole]
SYSTEMATIC NAME: 3,3'-spirobi[2,4-dihydro-[1,3]thiazino[3,2-a]benzimidazole]
MOLECULAR FORMULA: C19H16N4S2
MOLECULAR WEIGHT: 364.48714
SMILES: C1C2(CN3C4=CC=CC=C4N=C3SC2)CSC5=NC6=CC=CC=C6N51
Structure:
CAS RN: 70374-13-9
CAS Name: 3,3'-spirobi[2,4-dihydro-[1,3]oxazino[3,2-a]benzimidazole]
OPENEYE Name: 3,3'-spirobi[2,4-dihydro-[1,3]oxazino[3,2-a]benzimidazole]
IUPAC Name: 3,3'-spirobi[2,4-dihydro-[1,3]oxazino[3,2-a]benzimidazole]
SYSTEMATIC NAME: 3,3'-spirobi[2,4-dihydro-[1,3]oxazino[3,2-a]benzimidazole]
MOLECULAR FORMULA: C19H16N4O2
MOLECULAR WEIGHT: 332.35594
SMILES: C1C2(CN3C4=CC=CC=C4N=C3OC2)COC5=NC6=CC=CC=C6N51
Structure:
CAS RN: 60109-74-2
CAS Name: 2-nitro-N',N'-diphenylbenzohydrazide
OPENEYE Name: 2-nitro-N',N'-diphenyl-benzohydrazide
IUPAC Name: 2-nitro-N',N'-diphenylbenzohydrazide
SYSTEMATIC NAME: 2-nitro-N',N'-diphenyl-benzohydrazide
MOLECULAR FORMULA: C19H15N3O3
MOLECULAR WEIGHT: 333.3407
SMILES: C1=CC=C(C=C1)N(C2=CC=CC=C2)NC(=O)C3=CC=CC=C3[N+](=O)[O-]
Structure:
CAS RN: 60109-73-1
CAS Name: 2-[(2-nitrophenyl)methyl]-1,1-diphenylhydrazine
OPENEYE Name: 2-[(2-nitrophenyl)methyl]-1,1-diphenyl-hydrazine
IUPAC Name: 2-[(2-nitrophenyl)methyl]-1,1-diphenylhydrazine
SYSTEMATIC NAME: 2-[(2-nitrophenyl)methyl]-1,1-diphenyl-diazane
MOLECULAR FORMULA: C19H17N3O2
MOLECULAR WEIGHT: 319.35718
SMILES: C1=CC=C(C=C1)N(C2=CC=CC=C2)NCC3=CC=CC=C3[N+](=O)[O-]
Structure:
CAS RN: 60109-70-8
CAS Name: 1-[(2-nitrophenyl)methyl]-1-phenylhydrazine
OPENEYE Name: 1-[(2-nitrophenyl)methyl]-1-phenyl-hydrazine
IUPAC Name: 1-[(2-nitrophenyl)methyl]-1-phenylhydrazine
SYSTEMATIC NAME: 1-[(2-nitrophenyl)methyl]-1-phenyl-diazane
MOLECULAR FORMULA: C13H13N3O2
MOLECULAR WEIGHT: 243.26122
SMILES: C1=CC=C(C=C1)N(CC2=CC=CC=C2[N+](=O)[O-])N
Structure:
CAS RN: 23541-25-5
CAS Name: 9-[3,4-dihydroxy-5-(hydroxymethyl)-2-oxolanyl]-6-(2-phenylethylamino)-1H-purin-2-one
OPENEYE Name: 9-[3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-6-(2-phenylethylamino)-1H-purin-2-one
IUPAC Name: 9-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-6-(2-phenylethylamino)-1H-purin-2-one
SYSTEMATIC NAME: 9-[5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]-6-(2-phenylethylamino)-1H-purin-2-one
MOLECULAR FORMULA: C18H21N5O5
MOLECULAR WEIGHT: 387.38984
SMILES: C1=CC=C(C=C1)CCNC2=C3C(=NC(=O)N2)N(C=N3)C4C(C(C(O4)CO)O)O
Structure:
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