CAS RN: 8017-52-5
CAS Name: sodium 5,5-diphenylimidazolidin-3-ide-2,4-dione
OPENEYE Name: sodium 5,5-diphenylimidazolidin-3-ide-2,4-dione
IUPAC Name: sodium 5,5-diphenylimidazolidin-3-ide-2,4-dione
SYSTEMATIC NAME: sodium 5,5-diphenylimidazolidin-3-ide-2,4-dione
MOLECULAR FORMULA: C15H11N2NaO2
MOLECULAR WEIGHT: 274.24981
SMILES: C1=CC=C(C=C1)C2(C(=O)[N-]C(=O)N2)C3=CC=CC=C3.[Na+]
Structure:
CAS RN: 51-52-5
CAS Name: 6-propyl-2-sulfanylidene-1H-pyrimidin-4-one
OPENEYE Name: 6-propyl-2-thioxo-1H-pyrimidin-4-one
IUPAC Name: 6-propyl-2-sulfanylidene-1H-pyrimidin-4-one
SYSTEMATIC NAME: 6-propyl-2-sulfanylidene-1H-pyrimidin-4-one
MOLECULAR FORMULA: C7H10N2OS
MOLECULAR WEIGHT: 170.2321
SMILES: CCCC1=CC(=O)NC(=S)N1
Structure:
CAS RN: 500-50-5
CAS Name: 6-propyl-2-sulfanylidene-1H-pyrimidin-4-one
OPENEYE Name: 6-propyl-2-thioxo-1H-pyrimidin-4-one
IUPAC Name: 6-propyl-2-sulfanylidene-1H-pyrimidin-4-one
SYSTEMATIC NAME: 6-propyl-2-sulfanylidene-1H-pyrimidin-4-one
MOLECULAR FORMULA: C7H10N2OS
MOLECULAR WEIGHT: 170.2321
SMILES: CCCC1=CC(=O)NC(=S)N1
Structure:
CAS RN: 28319-77-9
CAS Name: [(2R)-2,3-dihydroxypropyl] 2-(trimethylammonio)ethyl phosphate
OPENEYE Name: [(2R)-2,3-dihydroxypropyl] 2-(trimethylammonio)ethyl phosphate
IUPAC Name: [(2R)-2,3-dihydroxypropyl] 2-(trimethylazaniumyl)ethyl phosphate
SYSTEMATIC NAME: [(2R)-2,3-bis(oxidanyl)propyl] 2-(trimethylazaniumyl)ethyl phosphate
MOLECULAR FORMULA: C8H20NO6P
MOLECULAR WEIGHT: 257.221261
SMILES: C[N+](C)(C)CCOP(=O)([O-])OC[C@@H](CO)O
Structure:
CAS RN: 541-22-0
CAS Name: trimethyl-[10-(trimethylammonio)decyl]ammonium bromide
OPENEYE Name: trimethyl-[10-(trimethylammonio)decyl]ammonium bromide
IUPAC Name: trimethyl-[10-(trimethylazaniumyl)decyl]azanium bromide
SYSTEMATIC NAME: trimethyl-[10-(trimethylazaniumyl)decyl]azanium bromide
MOLECULAR FORMULA: C16H38BrN2+
MOLECULAR WEIGHT: 338.39032
SMILES: C[N+](C)(C)CCCCCCCCCC[N+](C)(C)C.[Br-]
Structure:
CAS RN: 60-10-6
CAS Name: 1-anilino-3-phenyliminothiourea
OPENEYE Name: 1-anilino-3-phenylimino-thiourea
IUPAC Name: 1-anilino-3-phenyliminothiourea
SYSTEMATIC NAME: 1-phenylazanyl-3-phenylimino-thiourea
MOLECULAR FORMULA: C13H12N4S
MOLECULAR WEIGHT: 256.32618
SMILES: C1=CC=C(C=C1)NNC(=S)N=NC2=CC=CC=C2
Structure:
CAS RN: 30827-05-5
CAS Name: 1-anilino-3-phenyliminothiourea
OPENEYE Name: 1-anilino-3-phenylimino-thiourea
IUPAC Name: 1-anilino-3-phenyliminothiourea
SYSTEMATIC NAME: 1-phenylazanyl-3-phenylimino-thiourea
MOLECULAR FORMULA: C13H12N4S
MOLECULAR WEIGHT: 256.32618
SMILES: C1=CC=C(C=C1)NNC(=S)N=NC2=CC=CC=C2
Structure:
CAS RN: 555-88-4
CAS Name: 1-anilino-3-phenyliminothiourea
OPENEYE Name: 1-anilino-3-phenylimino-thiourea
IUPAC Name: 1-anilino-3-phenyliminothiourea
SYSTEMATIC NAME: 1-phenylazanyl-3-phenylimino-thiourea
MOLECULAR FORMULA: C13H12N4S
MOLECULAR WEIGHT: 256.32618
SMILES: C1=CC=C(C=C1)NNC(=S)N=NC2=CC=CC=C2
Structure:
CAS RN: 21679-14-1
CAS Name: (2R,3S,4S,5R)-2-(6-amino-2-fluoro-9-purinyl)-5-(hydroxymethyl)oxolane-3,4-diol
OPENEYE Name: (2R,3S,4S,5R)-2-(6-amino-2-fluoro-purin-9-yl)-5-(hydroxymethyl)tetrahydrofuran-3,4-diol
IUPAC Name: (2R,3S,4S,5R)-2-(6-amino-2-fluoropurin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol
SYSTEMATIC NAME: (2R,3S,4S,5R)-2-(6-azanyl-2-fluoranyl-purin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol
MOLECULAR FORMULA: C10H12FN5O4
MOLECULAR WEIGHT: 285.231783
SMILES: C1=NC2=C(N1[C@H]3[C@H]([C@@H]([C@H](O3)CO)O)O)N=C(N=C2N)F
Structure:
CAS RN: 29864-80-0
CAS Name: propanoic acid [4-[(E)-4-[4-(1-oxopropoxy)phenyl]hex-3-en-3-yl]phenyl] ester
OPENEYE Name: [4-[(E)-1-ethyl-2-(4-propanoyloxyphenyl)but-1-enyl]phenyl] propanoate
IUPAC Name: [4-[(E)-4-(4-propanoyloxyphenyl)hex-3-en-3-yl]phenyl] propanoate
SYSTEMATIC NAME: [4-[(E)-4-(4-propanoyloxyphenyl)hex-3-en-3-yl]phenyl] propanoate
MOLECULAR FORMULA: C24H28O4
MOLECULAR WEIGHT: 380.47672
SMILES: CC/C(=C(/CC)\C1=CC=C(C=C1)OC(=O)CC)/C2=CC=C(C=C2)OC(=O)CC
Structure:
CAS RN: 37221-14-0
CAS Name: propanoic acid [4-[(E)-4-[4-(1-oxopropoxy)phenyl]hex-3-en-3-yl]phenyl] ester
OPENEYE Name: [4-[(E)-1-ethyl-2-(4-propanoyloxyphenyl)but-1-enyl]phenyl] propanoate
IUPAC Name: [4-[(E)-4-(4-propanoyloxyphenyl)hex-3-en-3-yl]phenyl] propanoate
SYSTEMATIC NAME: [4-[(E)-4-(4-propanoyloxyphenyl)hex-3-en-3-yl]phenyl] propanoate
MOLECULAR FORMULA: C24H28O4
MOLECULAR WEIGHT: 380.47672
SMILES: CC/C(=C(/CC)\C1=CC=C(C=C1)OC(=O)CC)/C2=CC=C(C=C2)OC(=O)CC
Structure:
CAS RN: 80-50-2
CAS Name: 2-propylpentanoic acid [(1S,5R)-8,8-dimethyl-8-azoniabicyclo[3.2.1]octan-3-yl] ester bromide
OPENEYE Name: [(1S,5R)-8,8-dimethyl-8-azoniabicyclo[3.2.1]octan-3-yl] 2-propylpentanoate bromide
IUPAC Name: [(1S,5R)-8,8-dimethyl-8-azoniabicyclo[3.2.1]octan-3-yl] 2-propylpentanoate bromide
SYSTEMATIC NAME: [(1S,5R)-8,8-dimethyl-8-azoniabicyclo[3.2.1]octan-3-yl] 2-propylpentanoate bromide
MOLECULAR FORMULA: C17H32BrNO2
MOLECULAR WEIGHT: 362.34548
SMILES: CCCC(CCC)C(=O)OC1C[C@H]2CC[C@@H](C1)[N+]2(C)C.[Br-]
Structure:
CAS RN: 702676-93-5
CAS Name: N'-[3-[[5-bromo-2-[3-[[oxo(1-pyrrolidinyl)methyl]amino]anilino]-4-pyrimidinyl]amino]propyl]-2,2-dimethylpropanediamide
OPENEYE Name: N'-[3-[[5-bromo-2-[3-(pyrrolidine-1-carbonylamino)anilino]pyrimidin-4-yl]amino]propyl]-2,2-dimethyl-propanediamide
IUPAC Name: N'-[3-[[5-bromo-2-[3-(pyrrolidine-1-carbonylamino)anilino]pyrimidin-4-yl]amino]propyl]-2,2-dimethylpropanediamide
SYSTEMATIC NAME: N'-[3-[[5-bromanyl-2-[[3-(pyrrolidin-1-ylcarbonylamino)phenyl]amino]pyrimidin-4-yl]amino]propyl]-2,2-dimethyl-propanediamide
MOLECULAR FORMULA: C23H31BrN8O3
MOLECULAR WEIGHT: 547.44804
SMILES: CC(C)(C(=O)N)C(=O)NCCCNC1=NC(=NC=C1Br)NC2=CC(=CC=C2)NC(=O)N3CCCC3
Structure:
CAS RN: 181477-43-0
CAS Name: (2S)-2-[[(2S)-2-[[(2S)-2-[[[(2S)-1-[(2S)-2-[[(2S)-5-amino-2-[[(2S)-2-[[(2S)-2-[[(2S,3S)-2-amino-3-methyl-1-oxopentyl]amino]-4-(methylthio)-1-oxobutyl]amino]-3-carboxy-1-oxopropyl]amino]-1,5-dioxopentyl]amino]-3-methyl-1-oxobutyl]-2-pyrrolidinyl]-oxomethyl
OPENEYE Name: (2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-1-[(2S)-2-[[(2S)-5-amino-2-[[(2S)-2-[[(2S)-2-[[(2S,3S)-2-amino-3-methyl-pentanoyl]amino]-4-methylsulfanyl-butanoyl]amino]-3-carboxy-propanoyl]amino]-5-oxo-pentanoyl]amino]-3-methyl-butanoyl]pyrrolidine-2-carbonyl]amino]-3-p
IUPAC Name: (2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-1-[(2S)-2-[[(2S)-5-amino-2-[[(2S)-2-[[(2S)-2-[[(2S,3S)-2-amino-3-methylpentanoyl]amino]-4-methylsulfanylbutanoyl]amino]-3-carboxypropanoyl]amino]-5-oxopentanoyl]amino]-3-methylbutanoyl]pyrrolidine-2-carbonyl]amino]-3-phenyl
SYSTEMATIC NAME: (2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-1-[(2S)-2-[[(2S)-5-azanyl-2-[[(2S)-2-[[(2S)-2-[[(2S,3S)-2-azanyl-3-methyl-pentanoyl]amino]-4-methylsulfanyl-butanoyl]amino]-4-oxidanyl-4-oxidanylidene-butanoyl]amino]-5-oxidanylidene-pentanoyl]amino]-3-methyl-butanoyl]pyrro
MOLECULAR FORMULA: C47H74N10O14S
MOLECULAR WEIGHT: 1035.21406
SMILES: CC[C@H](C)[C@@H](C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)N[C@@H](CO)C(=O)N[C@@H](C(C)C)C(=O)O)N
Structure:
CAS RN: 59862-14-5
CAS Name: (E)-3-(3,4-dihydroxy-5-methoxyphenyl)-2-propenethioic acid S-[2-[[3-[[4-[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxy-2-oxolanyl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethyl-1-oxobutyl]amino]-1-oxopropyl]ami
OPENEYE Name: S-[2-[3-[[4-[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl]oxy-hydroxy-phosphoryl]oxy-2-hydroxy-3,3-dimethyl-butanoyl]amino]propanoylamino]ethyl] (E)-3-(3,4-dihydroxy-5-methoxy-phenyl)prop-2
IUPAC Name: S-[2-[3-[[4-[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethyl] (E)-3-(3,4-dihydroxy-5-methoxyphenyl)prop-2-enethioate
SYSTEMATIC NAME: S-[2-[3-[[4-[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-oxidanyl-3-phosphonooxy-oxolan-2-yl]methoxy-oxidanyl-phosphoryl]oxy-oxidanyl-phosphoryl]oxy-3,3-dimethyl-2-oxidanyl-butanoyl]amino]propanoylamino]ethyl] (E)-3-[3-methoxy-4,5-bis(oxidanyl)phenyl]prop-2-e
MOLECULAR FORMULA: C31H44N7O20P3S
MOLECULAR WEIGHT: 959.702243
SMILES: CC(C)(COP(=O)(O)OP(=O)(O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C2N=CN=C3N)O)OP(=O)(O)O)C(C(=O)NCCC(=O)NCCSC(=O)/C=C/C4=CC(=C(C(=C4)OC)O)O)O
Structure:
CAS RN: 55297-95-5
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C28H47NO4S
MOLECULAR WEIGHT: 493.74208
SMILES: CCN(CC)CCSCC(=O)O[C@@H]1C[C@@]([C@H]([C@@H]([C@@]23CC[C@H]([C@@]1([C@@H]2C(=O)CC3)C)C)C)O)(C)C=C
Structure:
CAS RN: 67411-64-7
CAS Name: 2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
OPENEYE Name: 2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
IUPAC Name: 2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
SYSTEMATIC NAME: 2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethyloxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
MOLECULAR FORMULA: C28H58O15
MOLECULAR WEIGHT: 634.75112
SMILES: C(COCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCO)O
Structure:
CAS RN: 85618-20-8
CAS Name: (2S,3R,4S,5S,6R)-2-(heptylthio)-6-(hydroxymethyl)oxane-3,4,5-triol
OPENEYE Name: (2S,3R,4S,5S,6R)-2-heptylsulfanyl-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol
IUPAC Name: (2S,3R,4S,5S,6R)-2-heptylsulfanyl-6-(hydroxymethyl)oxane-3,4,5-triol
SYSTEMATIC NAME: (2S,3R,4S,5S,6R)-2-heptylsulfanyl-6-(hydroxymethyl)oxane-3,4,5-triol
MOLECULAR FORMULA: C13H26O5S
MOLECULAR WEIGHT: 294.40754
SMILES: CCCCCCCS[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O
Structure:
CAS RN: 367-93-1
CAS Name: (2R,3R,4S,5R,6S)-2-(hydroxymethyl)-6-(propan-2-ylthio)oxane-3,4,5-triol
OPENEYE Name: (2R,3R,4S,5R,6S)-2-(hydroxymethyl)-6-isopropylsulfanyl-tetrahydropyran-3,4,5-triol
IUPAC Name: (2R,3R,4S,5R,6S)-2-(hydroxymethyl)-6-propan-2-ylsulfanyloxane-3,4,5-triol
SYSTEMATIC NAME: (2R,3R,4S,5R,6S)-2-(hydroxymethyl)-6-propan-2-ylsulfanyl-oxane-3,4,5-triol
MOLECULAR FORMULA: C9H18O5S
MOLECULAR WEIGHT: 238.30122
SMILES: CC(C)S[C@H]1[C@@H]([C@H]([C@H]([C@H](O1)CO)O)O)O
Structure:
No comments:
Post a Comment