Product OPENEYE NAME: N-[4-(1H-imidazol-5-yl)butyl]-N-[N'-[3-(1H-imidazol-5-yl)propyl]carbamimidoyl]benzamide
CAS Name: N-[amino-[3-(1H-imidazol-5-yl)propylimino]methyl]-N-[4-(1H-imidazol-5-yl)butyl]benzamide
IUPAC NAME: N-[4-(1H-imidazol-5-yl)butyl]-N-[N'-[3-(1H-imidazol-5-yl)propyl]carbamimidoyl]benzamide
SYSTEMATIC NAME: N-[4-(1H-imidazol-5-yl)butyl]-N-[N'-[3-(1H-imidazol-5-yl)propyl]carbamimidoyl]benzamide
MOLECULAR FORMULA: C21H27N7O
MOLECULAR WEIGHT: 393.48538
SMILES: C1=CC=C(C=C1)C(=O)N(CCCCC2=CN=CN2)C(=NCCCC3=CN=CN3)N
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Product OPENEYE NAME: 1-[4-(1H-imidazol-5-yl)butyl]-2-[3-(1H-imidazol-5-yl)propyl]guanidine trihydrochloride
CAS Name: 1-[4-(1H-imidazol-5-yl)butyl]-2-[3-(1H-imidazol-5-yl)propyl]guanidine trihydrochloride
IUPAC NAME: 1-[4-(1H-imidazol-5-yl)butyl]-2-[3-(1H-imidazol-5-yl)propyl]guanidine trihydrochloride
SYSTEMATIC NAME: 1-[4-(1H-imidazol-5-yl)butyl]-2-[3-(1H-imidazol-5-yl)propyl]guanidine trihydrochloride
MOLECULAR FORMULA: C14H26Cl3N7
MOLECULAR WEIGHT: 398.76214
SMILES: C1=C(NC=N1)CCCCNC(=NCCCC2=CN=CN2)N.Cl.Cl.Cl
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Product OPENEYE NAME: 1-cyano-1-[2-[[5-[(dimethylamino)methyl]-2-thienyl]methylsulfanyl]ethyl]-2-[3-(1H-imidazol-5-yl)propyl]guanidine
CAS Name: 1-cyano-1-[2-[[5-[(dimethylamino)methyl]-2-thiophenyl]methylthio]ethyl]-2-[3-(1H-imidazol-5-yl)propyl]guanidine
IUPAC NAME: 1-cyano-1-[2-[[5-[(dimethylamino)methyl]thiophen-2-yl]methylsulfanyl]ethyl]-2-[3-(1H-imidazol-5-yl)propyl]guanidine
SYSTEMATIC NAME: 1-cyano-1-[2-[[5-[(dimethylamino)methyl]thiophen-2-yl]methylsulfanyl]ethyl]-2-[3-(1H-imidazol-5-yl)propyl]guanidine
MOLECULAR FORMULA: C18H27N7S2
MOLECULAR WEIGHT: 405.58388
SMILES: CN(C)CC1=CC=C(S1)CSCCN(C#N)C(=NCCCC2=CN=CN2)N
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Product OPENEYE NAME: N-(5H-imidazo[1,5-c][1,3]diazepin-8-yl)benzamide
CAS Name: N-(5H-imidazo[1,5-c][1,3]diazepin-8-yl)benzamide
IUPAC NAME: N-(5H-imidazo[1,5-c][1,3]diazepin-8-yl)benzamide
SYSTEMATIC NAME: N-(5H-imidazo[1,5-c][1,3]diazepin-8-yl)benzamide
MOLECULAR FORMULA: C14H12N4O
MOLECULAR WEIGHT: 252.27128
SMILES: C1N=CC(=CC2=CN=CN21)NC(=O)C3=CC=CC=C3
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Product OPENEYE NAME: 1-[2-[[5-[(dimethylamino)methyl]-2-thienyl]methylsulfanyl]ethyl]-2-[3-(1H-imidazol-5-yl)propyl]guanidine trihydrochloride
CAS Name: 1-[2-[[5-[(dimethylamino)methyl]-2-thiophenyl]methylthio]ethyl]-2-[3-(1H-imidazol-5-yl)propyl]guanidine trihydrochloride
IUPAC NAME: 1-[2-[[5-[(dimethylamino)methyl]thiophen-2-yl]methylsulfanyl]ethyl]-2-[3-(1H-imidazol-5-yl)propyl]guanidine trihydrochloride
SYSTEMATIC NAME: 1-[2-[[5-[(dimethylamino)methyl]thiophen-2-yl]methylsulfanyl]ethyl]-2-[3-(1H-imidazol-5-yl)propyl]guanidine trihydrochloride
MOLECULAR FORMULA: C17H31Cl3N6S2
MOLECULAR WEIGHT: 489.95724
SMILES: CN(C)CC1=CC=C(S1)CSCCNC(=NCCCC2=CN=CN2)N.Cl.Cl.Cl
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Product OPENEYE NAME: 1-[2-[[5-[(dimethylamino)methyl]-2-thienyl]methylsulfanyl]ethyl]-2-[3-(1H-imidazol-5-yl)propyl]guanidine
CAS Name: 1-[2-[[5-[(dimethylamino)methyl]-2-thiophenyl]methylthio]ethyl]-2-[3-(1H-imidazol-5-yl)propyl]guanidine
IUPAC NAME: 1-[2-[[5-[(dimethylamino)methyl]thiophen-2-yl]methylsulfanyl]ethyl]-2-[3-(1H-imidazol-5-yl)propyl]guanidine
SYSTEMATIC NAME: 1-[2-[[5-[(dimethylamino)methyl]thiophen-2-yl]methylsulfanyl]ethyl]-2-[3-(1H-imidazol-5-yl)propyl]guanidine
MOLECULAR FORMULA: C17H28N6S2
MOLECULAR WEIGHT: 380.57442
SMILES: CN(C)CC1=CC=C(S1)CSCCNC(=NCCCC2=CN=CN2)N
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Product OPENEYE NAME: 1-[2-[[5-[(dimethylamino)methyl]-2-furyl]methylsulfanyl]ethyl]-2-[3-(1H-imidazol-5-yl)propyl]guanidine trihydrochloride
CAS Name: 1-[2-[[5-[(dimethylamino)methyl]-2-furanyl]methylthio]ethyl]-2-[3-(1H-imidazol-5-yl)propyl]guanidine trihydrochloride
IUPAC NAME: 1-[2-[[5-[(dimethylamino)methyl]furan-2-yl]methylsulfanyl]ethyl]-2-[3-(1H-imidazol-5-yl)propyl]guanidine trihydrochloride
SYSTEMATIC NAME: 1-[2-[[5-[(dimethylamino)methyl]furan-2-yl]methylsulfanyl]ethyl]-2-[3-(1H-imidazol-5-yl)propyl]guanidine trihydrochloride
MOLECULAR FORMULA: C17H31Cl3N6OS
MOLECULAR WEIGHT: 473.89164
SMILES: CN(C)CC1=CC=C(O1)CSCCNC(=NCCCC2=CN=CN2)N.Cl.Cl.Cl
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Product OPENEYE NAME: (8Z)-1,5,6,7,10,10a-hexahydroimidazo[1,5-c][1,3]diazocine
CAS Name: (8Z)-1,5,6,7,10,10a-hexahydroimidazo[1,5-c][1,3]diazocine
IUPAC NAME: (8Z)-1,5,6,7,10,10a-hexahydroimidazo[1,5-c][1,3]diazocine
SYSTEMATIC NAME: (8Z)-1,5,6,7,10,10a-hexahydroimidazo[1,5-c][1,3]diazocine
MOLECULAR FORMULA: C8H13N3
MOLECULAR WEIGHT: 151.20892
SMILES: C1/C=C\CNCN2C1CN=C2
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Product OPENEYE NAME: [1-(2-ethylhexanoylperoxy)-1-methyl-propyl] 2-ethylhexaneperoxoate
CAS Name: 2-ethylhexaneperoxoic acid 2-(2-ethyl-1-oxohexyl)dioxybutan-2-yl ester
IUPAC NAME: 2-(2-ethylhexanoylperoxy)butan-2-yl 2-ethylhexaneperoxoate
SYSTEMATIC NAME: 2-(2-ethylhexanoylperoxy)butan-2-yl 2-ethylhexaneperoxoate
MOLECULAR FORMULA: C20H38O6
MOLECULAR WEIGHT: 374.51212
SMILES: CCCCC(CC)C(=O)OOC(C)(CC)OOC(=O)C(CC)CCCC
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Product OPENEYE NAME: [1-ethyl-1-(2-ethylbutanoylperoxy)propyl] 2-ethylbutaneperoxoate
CAS Name: 2-ethylbutaneperoxoic acid 3-(2-ethyl-1-oxobutyl)dioxypentan-3-yl ester
IUPAC NAME: 3-(2-ethylbutanoylperoxy)pentan-3-yl 2-ethylbutaneperoxoate
SYSTEMATIC NAME: 3-(2-ethylbutanoylperoxy)pentan-3-yl 2-ethylbutaneperoxoate
MOLECULAR FORMULA: C17H32O6
MOLECULAR WEIGHT: 332.43238
SMILES: CCC(CC)C(=O)OOC(CC)(CC)OOC(=O)C(CC)CC
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Product OPENEYE NAME: (17-acetyl-6,10,13-trimethyl-16-methylene-3-oxo-1,2,6,7,8,9,11,12,14,15-decahydrocyclopenta[a]phenanthren-17-yl) acetate
CAS Name: acetic acid (17-acetyl-6,10,13-trimethyl-16-methylene-3-oxo-1,2,6,7,8,9,11,12,14,15-decahydrocyclopenta[a]phenanthren-17-yl) ester
IUPAC NAME: (17-acetyl-6,10,13-trimethyl-16-methylidene-3-oxo-1,2,6,7,8,9,11,12,14,15-decahydrocyclopenta[a]phenanthren-17-yl) acetate
SYSTEMATIC NAME: (17-ethanoyl-6,10,13-trimethyl-16-methylidene-3-oxidanylidene-1,2,6,7,8,9,11,12,14,15-decahydrocyclopenta[a]phenanthren-17-yl) ethanoate
MOLECULAR FORMULA: C25H34O4
MOLECULAR WEIGHT: 398.53506
SMILES: CC1CC2C(CCC3(C2CC(=C)C3(C(=O)C)OC(=O)C)C)C4(C1=CC(=O)CC4)C
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Product OPENEYE NAME: europium(2+); lanthanum(3+)
CAS Name: europium(2+); lanthanum(3+)
IUPAC NAME: europium(2+); lanthanum(3+)
SYSTEMATIC NAME: europium(2+); lanthanum(3+)
MOLECULAR FORMULA: EuLa+5
MOLECULAR WEIGHT: 290.8695
SMILES: [La+3].[Eu+2]
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Product OPENEYE NAME: calcium hydrogen sulfide phenoxide
CAS Name: calcium sulfane phenoxide
IUPAC NAME: calcium sulfane phenoxide
SYSTEMATIC NAME: calcium sulfane phenoxide
MOLECULAR FORMULA: C6H7CaOS+
MOLECULAR WEIGHT: 167.26218
SMILES: C1=CC=C(C=C1)[O-].S.[Ca+2]
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Product OPENEYE NAME: 1,3-dimethyl-7H-purine-2,6-dione; 2-(methylamino)-1-phenyl-propan-1-ol
CAS Name: 1,3-dimethyl-7H-purine-2,6-dione; 2-(methylamino)-1-phenyl-1-propanol
IUPAC NAME: 1,3-dimethyl-7H-purine-2,6-dione; 2-(methylamino)-1-phenylpropan-1-ol
SYSTEMATIC NAME: 1,3-dimethyl-7H-purine-2,6-dione; 2-(methylamino)-1-phenyl-propan-1-ol
MOLECULAR FORMULA: C17H23N5O3
MOLECULAR WEIGHT: 345.39622
SMILES: CC(C(C1=CC=CC=C1)O)NC.CN1C2=C(C(=O)N(C1=O)C)NC=N2
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Product OPENEYE NAME: acetic acid; 2-amino-9-[3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-3H-purine-6-thione
CAS Name: acetic acid; 2-amino-9-[3,4-dihydroxy-5-(hydroxymethyl)-2-oxolanyl]-3H-purine-6-thione
IUPAC NAME: acetic acid; 2-amino-9-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3H-purine-6-thione
SYSTEMATIC NAME: 2-azanyl-9-[5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]-3H-purine-6-thione; ethanoic acid
MOLECULAR FORMULA: C16H25N5O10S
MOLECULAR WEIGHT: 479.4622
SMILES: CC(=O)O.CC(=O)O.CC(=O)O.C1=NC2=C(N1C3C(C(C(O3)CO)O)O)NC(=NC2=S)N
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Product OPENEYE NAME: methyl 1-(2-methyl-3-thioxo-propanoyl)pyrrolidine-2-carboxylate
CAS Name: 1-(2-methyl-1-oxo-3-sulfanylidenepropyl)-2-pyrrolidinecarboxylic acid methyl ester
IUPAC NAME: methyl 1-(2-methyl-3-sulfanylidenepropanoyl)pyrrolidine-2-carboxylate
SYSTEMATIC NAME: methyl 1-(2-methyl-3-sulfanylidene-propanoyl)pyrrolidine-2-carboxylate
MOLECULAR FORMULA: C10H15NO3S
MOLECULAR WEIGHT: 229.296
SMILES: CC(C=S)C(=O)N1CCCC1C(=O)OC
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Product OPENEYE NAME: N-methylbenzamide; N-methylmethanamine
CAS Name: N-methylbenzamide; N-methylmethanamine
IUPAC NAME: N-methylbenzamide; N-methylmethanamine
SYSTEMATIC NAME: N-methylbenzamide; N-methylmethanamine
MOLECULAR FORMULA: C10H16N2O
MOLECULAR WEIGHT: 180.24684
SMILES: CNC.CNC(=O)C1=CC=CC=C1
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Product OPENEYE NAME: 2-amino-3-(4-hydroxyphenyl)propanoic acid; 2-amino-3-methyl-pentanoic acid
CAS Name: 2-amino-3-(4-hydroxyphenyl)propanoic acid; 2-amino-3-methylpentanoic acid
IUPAC NAME: 2-amino-3-(4-hydroxyphenyl)propanoic acid; 2-amino-3-methylpentanoic acid
SYSTEMATIC NAME: 2-azanyl-3-(4-hydroxyphenyl)propanoic acid; 2-azanyl-3-methyl-pentanoic acid
MOLECULAR FORMULA: C15H24N2O5
MOLECULAR WEIGHT: 312.36146
SMILES: CCC(C)C(C(=O)O)N.C1=CC(=CC=C1CC(C(=O)O)N)O
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