CAS RN: 16888-03-2
CAS Name: 2-[[2,4,6-tris(2-hydroxyethylamino)-8-pyrimido[5,4-d]pyrimidinyl]amino]ethanol
OPENEYE Name: 2-[[2,4,6-tris(2-hydroxyethylamino)pyrimido[5,4-d]pyrimidin-8-yl]amino]ethanol
IUPAC Name: 2-[[2,4,6-tris(2-hydroxyethylamino)pyrimido[5,4-d]pyrimidin-8-yl]amino]ethanol
SYSTEMATIC NAME: 2-[[2,4,6-tris(2-hydroxyethylamino)pyrimido[5,4-d]pyrimidin-8-yl]amino]ethanol
MOLECULAR FORMULA: C14H24N8O4
MOLECULAR WEIGHT: 368.39156
SMILES: C(CO)NC1=NC(=NC2=C1N=C(N=C2NCCO)NCCO)NCCO
Structure:
CAS RN: 16908-41-1
CAS Name: 2-[[8-[bis(2-hydroxyethyl)amino]-2,6-bis(diethylamino)-4-pyrimido[5,4-d]pyrimidinyl]-(2-hydroxyethyl)amino]ethanol
OPENEYE Name: 2-[[8-[bis(2-hydroxyethyl)amino]-2,6-bis(diethylamino)pyrimido[5,4-d]pyrimidin-4-yl]-(2-hydroxyethyl)amino]ethanol
IUPAC Name: 2-[[8-[bis(2-hydroxyethyl)amino]-2,6-bis(diethylamino)pyrimido[5,4-d]pyrimidin-4-yl]-(2-hydroxyethyl)amino]ethanol
SYSTEMATIC NAME: 2-[[8-[bis(2-hydroxyethyl)amino]-2,6-bis(diethylamino)pyrimido[5,4-d]pyrimidin-4-yl]-(2-hydroxyethyl)amino]ethanol
MOLECULAR FORMULA: C22H40N8O4
MOLECULAR WEIGHT: 480.6042
SMILES: CCN(CC)C1=NC2=C(C(=N1)N(CCO)CCO)N=C(N=C2N(CCO)CCO)N(CC)CC
Structure:
CAS RN: 16908-39-7
CAS Name: 2-[[8-[bis(2-hydroxyethyl)amino]-2,6-bis(1-piperidinyl)-4-pyrimido[5,4-d]pyrimidinyl]-(2-hydroxyethyl)amino]ethanol
OPENEYE Name: 2-[[8-[bis(2-hydroxyethyl)amino]-2,6-bis(1-piperidyl)pyrimido[5,4-d]pyrimidin-4-yl]-(2-hydroxyethyl)amino]ethanol
IUPAC Name: 2-[[8-[bis(2-hydroxyethyl)amino]-2,6-di(piperidin-1-yl)pyrimido[5,4-d]pyrimidin-4-yl]-(2-hydroxyethyl)amino]ethanol
SYSTEMATIC NAME: 2-[[8-[bis(2-hydroxyethyl)amino]-2,6-di(piperidin-1-yl)pyrimido[5,4-d]pyrimidin-4-yl]-(2-hydroxyethyl)amino]ethanol
MOLECULAR FORMULA: C24H40N8O4
MOLECULAR WEIGHT: 504.6256
SMILES: C1CCN(CC1)C2=NC3=C(C(=N2)N(CCO)CCO)N=C(N=C3N(CCO)CCO)N4CCCCC4
Structure:
CAS RN: 29878-98-6
CAS Name: N-methyl-N-(2-naphthalenylazo)methanamine
OPENEYE Name: N-methyl-N-(2-naphthylazo)methanamine
IUPAC Name: N-methyl-N-(naphthalen-2-yldiazenyl)methanamine
SYSTEMATIC NAME: N-methyl-N-(naphthalen-2-yldiazenyl)methanamine
MOLECULAR FORMULA: C12H13N3
MOLECULAR WEIGHT: 199.25172
SMILES: CN(C)N=NC1=CC2=CC=CC=C2C=C1
Structure:
CAS RN: 51553-22-1
CAS Name: N-(4-methoxy-2-nitrophenyl)azo-N-methylmethanamine
OPENEYE Name: N-(4-methoxy-2-nitro-phenyl)azo-N-methyl-methanamine
IUPAC Name: N-[(4-methoxy-2-nitrophenyl)diazenyl]-N-methylmethanamine
SYSTEMATIC NAME: N-[(4-methoxy-2-nitro-phenyl)diazenyl]-N-methyl-methanamine
MOLECULAR FORMULA: C9H12N4O3
MOLECULAR WEIGHT: 224.21658
SMILES: CN(C)N=NC1=C(C=C(C=C1)OC)[N+](=O)[O-]
Structure:
CAS RN: 89978-63-2
CAS Name: 1-aziridinyl-(4-bromophenyl)diazene
OPENEYE Name: aziridin-1-yl-(4-bromophenyl)diazene
IUPAC Name: aziridin-1-yl-(4-bromophenyl)diazene
SYSTEMATIC NAME: aziridin-1-yl-(4-bromophenyl)diazene
MOLECULAR FORMULA: C8H8BrN3
MOLECULAR WEIGHT: 226.07322
SMILES: C1CN1N=NC2=CC=C(C=C2)Br
Structure:
CAS RN: 23000-37-5
CAS Name: 1,5-dihydropyrimido[5,4-d]pyrimidine-4,6,8-trione
OPENEYE Name: 1,5-dihydropyrimido[5,4-d]pyrimidine-4,6,8-trione
IUPAC Name: 1,5-dihydropyrimido[5,4-d]pyrimidine-4,6,8-trione
SYSTEMATIC NAME: 1,5-dihydropyrimido[5,4-d]pyrimidine-4,6,8-trione
MOLECULAR FORMULA: C6H4N4O3
MOLECULAR WEIGHT: 180.12096
SMILES: C1=NC(=O)C2=C(N1)C(=O)NC(=O)N2
Structure:
CAS RN: 92474-94-7
CAS Name: 1,3,7-trimethylpyrimido[5,4-d]pyrimidine-2,4,8-trione
OPENEYE Name: 1,3,7-trimethylpyrimido[5,4-d]pyrimidine-2,4,8-trione
IUPAC Name: 1,3,7-trimethylpyrimido[5,4-d]pyrimidine-2,4,8-trione
SYSTEMATIC NAME: 1,3,7-trimethylpyrimido[5,4-d]pyrimidine-2,4,8-trione
MOLECULAR FORMULA: C9H10N4O3
MOLECULAR WEIGHT: 222.2007
SMILES: CN1C=NC2=C(C1=O)N(C(=O)N(C2=O)C)C
Structure:
CAS RN: 100569-82-2
CAS Name: acetic acid [1-(2-acetyloxy-1-naphthalenyl)-2-naphthalenyl] ester
OPENEYE Name: [1-(2-acetoxy-1-naphthyl)-2-naphthyl] acetate
IUPAC Name: [1-(2-acetyloxynaphthalen-1-yl)naphthalen-2-yl] acetate
SYSTEMATIC NAME: [1-(2-acetyloxynaphthalen-1-yl)naphthalen-2-yl] ethanoate
MOLECULAR FORMULA: C24H18O4
MOLECULAR WEIGHT: 370.39732
SMILES: CC(=O)OC1=C(C2=CC=CC=C2C=C1)C3=C(C=CC4=CC=CC=C43)OC(=O)C
Structure:
CAS RN: 53372-63-7
CAS Name: 2-(6-chloro-9-purinyl)-6-methyloxane-3,4,5-triol
OPENEYE Name: 2-(6-chloropurin-9-yl)-6-methyl-tetrahydropyran-3,4,5-triol
IUPAC Name: 2-(6-chloropurin-9-yl)-6-methyloxane-3,4,5-triol
SYSTEMATIC NAME: 2-(6-chloranylpurin-9-yl)-6-methyl-oxane-3,4,5-triol
MOLECULAR FORMULA: C11H13ClN4O4
MOLECULAR WEIGHT: 300.69832
SMILES: CC1C(C(C(C(O1)N2C=NC3=C2N=CN=C3Cl)O)O)O
Structure:
CAS RN: 92294-73-0
CAS Name: 4-[2-chloro-4-(4-morpholinyl)-8-pyrimido[5,4-d]pyrimidinyl]morpholine
OPENEYE Name: 4-(2-chloro-4-morpholino-pyrimido[5,4-d]pyrimidin-8-yl)morpholine
IUPAC Name: 4-(2-chloro-4-morpholin-4-ylpyrimido[5,4-d]pyrimidin-8-yl)morpholine
SYSTEMATIC NAME: 4-(2-chloranyl-4-morpholin-4-yl-pyrimido[5,4-d]pyrimidin-8-yl)morpholine
MOLECULAR FORMULA: C14H17ClN6O2
MOLECULAR WEIGHT: 336.77678
SMILES: C1COCCN1C2=NC(=NC3=C2N=CN=C3N4CCOCC4)Cl
Structure:
CAS RN: 68030-09-1
CAS Name: 2-[[2,6-dichloro-4-(2-hydroxyethylamino)-8-pyrimido[5,4-d]pyrimidinyl]amino]ethanol
OPENEYE Name: 2-[[2,6-dichloro-4-(2-hydroxyethylamino)pyrimido[5,4-d]pyrimidin-8-yl]amino]ethanol
IUPAC Name: 2-[[2,6-dichloro-4-(2-hydroxyethylamino)pyrimido[5,4-d]pyrimidin-8-yl]amino]ethanol
SYSTEMATIC NAME: 2-[[2,6-bis(chloranyl)-4-(2-hydroxyethylamino)pyrimido[5,4-d]pyrimidin-8-yl]amino]ethanol
MOLECULAR FORMULA: C10H12Cl2N6O2
MOLECULAR WEIGHT: 319.14728
SMILES: C(CO)NC1=NC(=NC2=C1N=C(N=C2NCCO)Cl)Cl
Structure:
CAS RN: 89281-25-4
CAS Name: 2,6-dichloropyrimido[5,4-d]pyrimidine-4,8-diamine
OPENEYE Name: 2,6-dichloropyrimido[5,4-d]pyrimidine-4,8-diamine
IUPAC Name: 2,6-dichloropyrimido[5,4-d]pyrimidine-4,8-diamine
SYSTEMATIC NAME: 2,6-bis(chloranyl)pyrimido[5,4-d]pyrimidine-4,8-diamine
MOLECULAR FORMULA: C6H4Cl2N6
MOLECULAR WEIGHT: 231.04216
SMILES: C12=C(C(=NC(=N1)Cl)N)N=C(N=C2N)Cl
Structure:
CAS RN: 68030-10-4
CAS Name: 2-[[4-[bis(2-hydroxyethyl)amino]-2,6-dichloro-8-pyrimido[5,4-d]pyrimidinyl]-(2-hydroxyethyl)amino]ethanol
OPENEYE Name: 2-[[4-[bis(2-hydroxyethyl)amino]-2,6-dichloro-pyrimido[5,4-d]pyrimidin-8-yl]-(2-hydroxyethyl)amino]ethanol
IUPAC Name: 2-[[4-[bis(2-hydroxyethyl)amino]-2,6-dichloropyrimido[5,4-d]pyrimidin-8-yl]-(2-hydroxyethyl)amino]ethanol
SYSTEMATIC NAME: 2-[[4-[bis(2-hydroxyethyl)amino]-2,6-bis(chloranyl)pyrimido[5,4-d]pyrimidin-8-yl]-(2-hydroxyethyl)amino]ethanol
MOLECULAR FORMULA: C14H20Cl2N6O4
MOLECULAR WEIGHT: 407.2524
SMILES: C(CO)N(CCO)C1=NC(=NC2=C1N=C(N=C2N(CCO)CCO)Cl)Cl
Structure:
CAS RN: 54093-81-1
CAS Name: 4-[2,6-dichloro-4-(4-morpholinyl)-8-pyrimido[5,4-d]pyrimidinyl]morpholine
OPENEYE Name: 4-(2,6-dichloro-4-morpholino-pyrimido[5,4-d]pyrimidin-8-yl)morpholine
IUPAC Name: 4-(2,6-dichloro-4-morpholin-4-ylpyrimido[5,4-d]pyrimidin-8-yl)morpholine
SYSTEMATIC NAME: 4-[2,6-bis(chloranyl)-4-morpholin-4-yl-pyrimido[5,4-d]pyrimidin-8-yl]morpholine
MOLECULAR FORMULA: C14H16Cl2N6O2
MOLECULAR WEIGHT: 371.22184
SMILES: C1COCCN1C2=NC(=NC3=C2N=C(N=C3N4CCOCC4)Cl)Cl
Structure:
CAS RN: 89981-54-4
CAS Name: 2-chloro-N4,N8-dimethylpyrimido[5,4-d]pyrimidine-4,8-diamine
OPENEYE Name: 2-chloro-N4,N8-dimethyl-pyrimido[5,4-d]pyrimidine-4,8-diamine
IUPAC Name: 2-chloro-4-N,8-N-dimethylpyrimido[5,4-d]pyrimidine-4,8-diamine
SYSTEMATIC NAME: 2-chloranyl-N4,N8-dimethyl-pyrimido[5,4-d]pyrimidine-4,8-diamine
MOLECULAR FORMULA: C8H9ClN6
MOLECULAR WEIGHT: 224.65026
SMILES: CNC1=NC(=NC2=C1N=CN=C2NC)Cl
Structure:
CAS RN: 55242-53-0
CAS Name: 1,3,7-tris(2-oxopropyl)purine-2,6-dione
OPENEYE Name: 1,3,7-triacetonylpurine-2,6-dione
IUPAC Name: 1,3,7-tris(2-oxopropyl)purine-2,6-dione
SYSTEMATIC NAME: 1,3,7-tris(2-oxidanylidenepropyl)purine-2,6-dione
MOLECULAR FORMULA: C14H16N4O5
MOLECULAR WEIGHT: 320.30064
SMILES: CC(=O)CN1C=NC2=C1C(=O)N(C(=O)N2CC(=O)C)CC(=O)C
Structure:
CAS RN: 56865-08-8
CAS Name: 1-(2-chloroethyl)-3,7-dimethylpurine-2,6-dione
OPENEYE Name: 1-(2-chloroethyl)-3,7-dimethyl-purine-2,6-dione
IUPAC Name: 1-(2-chloroethyl)-3,7-dimethylpurine-2,6-dione
SYSTEMATIC NAME: 1-(2-chloroethyl)-3,7-dimethyl-purine-2,6-dione
MOLECULAR FORMULA: C9H11ClN4O2
MOLECULAR WEIGHT: 242.66224
SMILES: CN1C=NC2=C1C(=O)N(C(=O)N2C)CCCl
Structure:
CAS RN: 10226-64-9
CAS Name: 1,3-dimethyl-7-(2-oxopropyl)purine-2,6-dione
OPENEYE Name: 7-acetonyl-1,3-dimethyl-purine-2,6-dione
IUPAC Name: 1,3-dimethyl-7-(2-oxopropyl)purine-2,6-dione
SYSTEMATIC NAME: 1,3-dimethyl-7-(2-oxidanylidenepropyl)purine-2,6-dione
MOLECULAR FORMULA: C10H12N4O3
MOLECULAR WEIGHT: 236.22728
SMILES: CC(=O)CN1C=NC2=C1C(=O)N(C(=O)N2C)C
Structure:
CAS RN: 41078-01-7
CAS Name: 3-ethyl-7H-purine-2,6-dione
OPENEYE Name: 3-ethyl-7H-purine-2,6-dione
IUPAC Name: 3-ethyl-7H-purine-2,6-dione
SYSTEMATIC NAME: 3-ethyl-7H-purine-2,6-dione
MOLECULAR FORMULA: C7H8N4O2
MOLECULAR WEIGHT: 180.16402
SMILES: CCN1C2=C(C(=O)NC1=O)NC=N2
Structure:
CAS RN: 31542-51-5
CAS Name: 1,3-diethyl-7-(2-hydroxyethyl)purine-2,6-dione
OPENEYE Name: 1,3-diethyl-7-(2-hydroxyethyl)purine-2,6-dione
IUPAC Name: 1,3-diethyl-7-(2-hydroxyethyl)purine-2,6-dione
SYSTEMATIC NAME: 1,3-diethyl-7-(2-hydroxyethyl)purine-2,6-dione
MOLECULAR FORMULA: C11H16N4O3
MOLECULAR WEIGHT: 252.26974
SMILES: CCN1C2=C(C(=O)N(C1=O)CC)N(C=N2)CCO
Structure:
CAS RN: 139927-86-9
CAS Name: 3,7-bis(phenylmethyl)purine-2,6-dione
OPENEYE Name: 3,7-dibenzylpurine-2,6-dione
IUPAC Name: 3,7-dibenzylpurine-2,6-dione
SYSTEMATIC NAME: 3,7-bis(phenylmethyl)purine-2,6-dione
MOLECULAR FORMULA: C19H16N4O2
MOLECULAR WEIGHT: 332.35594
SMILES: C1=CC=C(C=C1)CN2C=NC3=C2C(=O)NC(=O)N3CC4=CC=CC=C4
Structure:
CAS RN: 55242-69-8
CAS Name: 7-butyl-3-methylpurine-2,6-dione
OPENEYE Name: 7-butyl-3-methyl-purine-2,6-dione
IUPAC Name: 7-butyl-3-methylpurine-2,6-dione
SYSTEMATIC NAME: 7-butyl-3-methyl-purine-2,6-dione
MOLECULAR FORMULA: C10H14N4O2
MOLECULAR WEIGHT: 222.24376
SMILES: CCCCN1C=NC2=C1C(=O)NC(=O)N2C
Structure:
CAS RN: 31617-39-7
CAS Name: 1,3-diethyl-7-methylpurine-2,6-dione
OPENEYE Name: 1,3-diethyl-7-methyl-purine-2,6-dione
IUPAC Name: 1,3-diethyl-7-methylpurine-2,6-dione
SYSTEMATIC NAME: 1,3-diethyl-7-methyl-purine-2,6-dione
MOLECULAR FORMULA: C10H14N4O2
MOLECULAR WEIGHT: 222.24376
SMILES: CCN1C2=C(C(=O)N(C1=O)CC)N(C=N2)C
Structure:
CAS RN: 53432-05-6
CAS Name: 3,7-diethyl-1-methylpurine-2,6-dione
OPENEYE Name: 3,7-diethyl-1-methyl-purine-2,6-dione
IUPAC Name: 3,7-diethyl-1-methylpurine-2,6-dione
SYSTEMATIC NAME: 3,7-diethyl-1-methyl-purine-2,6-dione
MOLECULAR FORMULA: C10H14N4O2
MOLECULAR WEIGHT: 222.24376
SMILES: CCN1C=NC2=C1C(=O)N(C(=O)N2CC)C
Structure:
CAS RN: 54889-96-2
CAS Name: 1,7-diethyl-3-methylpurine-2,6-dione
OPENEYE Name: 1,7-diethyl-3-methyl-purine-2,6-dione
IUPAC Name: 1,7-diethyl-3-methylpurine-2,6-dione
SYSTEMATIC NAME: 1,7-diethyl-3-methyl-purine-2,6-dione
MOLECULAR FORMULA: C10H14N4O2
MOLECULAR WEIGHT: 222.24376
SMILES: CCN1C=NC2=C1C(=O)N(C(=O)N2C)CC
Structure:
CAS RN: 55242-68-7
CAS Name: 7-ethyl-3-methylpurine-2,6-dione
OPENEYE Name: 7-ethyl-3-methyl-purine-2,6-dione
IUPAC Name: 7-ethyl-3-methylpurine-2,6-dione
SYSTEMATIC NAME: 7-ethyl-3-methyl-purine-2,6-dione
MOLECULAR FORMULA: C8H10N4O2
MOLECULAR WEIGHT: 194.1906
SMILES: CCN1C=NC2=C1C(=O)NC(=O)N2C
Structure:
CAS RN: 5253-70-3
CAS Name: 3,7-diethylpurine-2,6-dione
OPENEYE Name: 3,7-diethylpurine-2,6-dione
IUPAC Name: 3,7-diethylpurine-2,6-dione
SYSTEMATIC NAME: 3,7-diethylpurine-2,6-dione
MOLECULAR FORMULA: C9H12N4O2
MOLECULAR WEIGHT: 208.21718
SMILES: CCN1C=NC2=C1C(=O)NC(=O)N2CC
Structure:
CAS RN: 53432-04-5
CAS Name: 3,7-diethylpurine-2,6-dione
OPENEYE Name: 3,7-diethylpurine-2,6-dione
IUPAC Name: 3,7-diethylpurine-2,6-dione
SYSTEMATIC NAME: 3,7-diethylpurine-2,6-dione
MOLECULAR FORMULA: C9H12N4O2
MOLECULAR WEIGHT: 208.21718
SMILES: CCN1C=NC2=C1C(=O)NC(=O)N2CC
Structure:
CAS RN: 29878-94-2
CAS Name: N-(3-bromophenyl)azo-N-methylmethanamine
OPENEYE Name: N-(3-bromophenyl)azo-N-methyl-methanamine
IUPAC Name: N-[(3-bromophenyl)diazenyl]-N-methylmethanamine
SYSTEMATIC NAME: N-[(3-bromophenyl)diazenyl]-N-methyl-methanamine
MOLECULAR FORMULA: C8H10BrN3
MOLECULAR WEIGHT: 228.0891
SMILES: CN(C)N=NC1=CC(=CC=C1)Br
Structure:
CAS RN: 91769-01-6
CAS Name: 6-methyl-N-(phenylmethyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine
OPENEYE Name: N-benzyl-6-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-amine
IUPAC Name: N-benzyl-6-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-amine
SYSTEMATIC NAME: 6-methyl-N-(phenylmethyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine
MOLECULAR FORMULA: C13H13N5
MOLECULAR WEIGHT: 239.27582
SMILES: CC1=NC2=C(C=NN2)C(=N1)NCC3=CC=CC=C3
Structure:
CAS RN: 92458-14-5
CAS Name: N-ethyl-6-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-amine
OPENEYE Name: N-ethyl-6-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-amine
IUPAC Name: N-ethyl-6-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-amine
SYSTEMATIC NAME: N-ethyl-6-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-amine
MOLECULAR FORMULA: C8H11N5
MOLECULAR WEIGHT: 177.20644
SMILES: CCNC1=NC(=NC2=C1C=NN2)C
Structure:
CAS RN: 93256-55-4
CAS Name: 1-(2-chlorophenyl)-6-methyl-4-pyrazolo[3,4-d]pyrimidinamine
OPENEYE Name: 1-(2-chlorophenyl)-6-methyl-pyrazolo[3,4-d]pyrimidin-4-amine
IUPAC Name: 1-(2-chlorophenyl)-6-methylpyrazolo[3,4-d]pyrimidin-4-amine
SYSTEMATIC NAME: 1-(2-chlorophenyl)-6-methyl-pyrazolo[3,4-d]pyrimidin-4-amine
MOLECULAR FORMULA: C12H10ClN5
MOLECULAR WEIGHT: 259.6943
SMILES: CC1=NC2=C(C=NN2C3=CC=CC=C3Cl)C(=N1)N
Structure:
CAS RN: 68380-54-1
CAS Name: (1-phenyl-4-pyrazolo[3,4-d]pyrimidinyl)hydrazine
OPENEYE Name: (1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)hydrazine
IUPAC Name: (1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)hydrazine
SYSTEMATIC NAME: (1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)diazane
MOLECULAR FORMULA: C11H10N6
MOLECULAR WEIGHT: 226.2373
SMILES: C1=CC=C(C=C1)N2C3=C(C=N2)C(=NC=N3)NN
Structure:
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