Product OPENEYE NAME: trimethoxy(thioxo)-$l^{5}-phosphane
CAS Name: trimethoxy(sulfanylidene)phosphorane
IUPAC NAME: trimethoxy(sulfanylidene)-$l^{5}-phosphane
SYSTEMATIC NAME: trimethoxy(sulfanylidene)-$l^{5}-phosphane
MOLECULAR FORMULA: C3H9O3PS
MOLECULAR WEIGHT: 156.140521
SMILES: COP(=S)(OC)OC
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Product OPENEYE NAME: [methoxy(methylsulfanyl)phosphoryl]oxymethane
CAS Name: [methoxy-(methylthio)phosphoryl]oxymethane
IUPAC NAME: [methoxy(methylsulfanyl)phosphoryl]oxymethane
SYSTEMATIC NAME: [methoxy(methylsulfanyl)phosphoryl]oxymethane
MOLECULAR FORMULA: C3H9O3PS
MOLECULAR WEIGHT: 156.140521
SMILES: COP(=O)(OC)SC
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Product OPENEYE NAME: 2-[[2-[2-[diethyl-[(2-methoxyphenyl)methyl]ammonio]ethylamino]-2-oxo-acetyl]amino]ethyl-diethyl-[(2-methoxyphenyl)methyl]ammonium dichloride
CAS Name: 2-[[2-[2-[diethyl-[(2-methoxyphenyl)methyl]ammonio]ethylamino]-1,2-dioxoethyl]amino]ethyl-diethyl-[(2-methoxyphenyl)methyl]ammonium dichloride
IUPAC NAME: 2-[[2-[2-[diethyl-[(2-methoxyphenyl)methyl]azaniumyl]ethylamino]-2-oxoacetyl]amino]ethyl-diethyl-[(2-methoxyphenyl)methyl]azanium dichloride
SYSTEMATIC NAME: 2-[[2-[2-[diethyl-[(2-methoxyphenyl)methyl]azaniumyl]ethylamino]-2-oxidanylidene-ethanoyl]amino]ethyl-diethyl-[(2-methoxyphenyl)methyl]azanium dichloride
MOLECULAR FORMULA: C30H48Cl2N4O4
MOLECULAR WEIGHT: 599.63252
SMILES: CC[N+](CC)(CCNC(=O)C(=O)NCC[N+](CC)(CC)CC1=CC=CC=C1OC)CC2=CC=CC=C2OC.[Cl-].[Cl-]
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Product OPENEYE NAME: 2-[[2-[2-[diethyl-[(2-methoxyphenyl)methyl]ammonio]ethylamino]-2-oxo-acetyl]amino]ethyl-diethyl-[(2-methoxyphenyl)methyl]ammonium
CAS Name: 2-[[2-[2-[diethyl-[(2-methoxyphenyl)methyl]ammonio]ethylamino]-1,2-dioxoethyl]amino]ethyl-diethyl-[(2-methoxyphenyl)methyl]ammonium
IUPAC NAME: 2-[[2-[2-[diethyl-[(2-methoxyphenyl)methyl]azaniumyl]ethylamino]-2-oxoacetyl]amino]ethyl-diethyl-[(2-methoxyphenyl)methyl]azanium
SYSTEMATIC NAME: 2-[[2-[2-[diethyl-[(2-methoxyphenyl)methyl]azaniumyl]ethylamino]-2-oxidanylidene-ethanoyl]amino]ethyl-diethyl-[(2-methoxyphenyl)methyl]azanium
MOLECULAR FORMULA: C30H48N4O4+2
MOLECULAR WEIGHT: 528.72652
SMILES: CC[N+](CC)(CCNC(=O)C(=O)NCC[N+](CC)(CC)CC1=CC=CC=C1OC)CC2=CC=CC=C2OC
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Product OPENEYE NAME: (2-chlorophenyl)methyl-[3-[[2-[3-[(2-chlorophenyl)methyl-diethyl-ammonio]propylamino]-2-oxo-acetyl]amino]propyl]-diethyl-ammonium dichloride
CAS Name: (2-chlorophenyl)methyl-[3-[[2-[3-[(2-chlorophenyl)methyl-diethylammonio]propylamino]-1,2-dioxoethyl]amino]propyl]-diethylammonium dichloride
IUPAC NAME: (2-chlorophenyl)methyl-[3-[[2-[3-[(2-chlorophenyl)methyl-diethylazaniumyl]propylamino]-2-oxoacetyl]amino]propyl]-diethylazanium dichloride
SYSTEMATIC NAME: (2-chlorophenyl)methyl-[3-[[2-[3-[(2-chlorophenyl)methyl-diethyl-azaniumyl]propylamino]-2-oxidanylidene-ethanoyl]amino]propyl]-diethyl-azanium dichloride
MOLECULAR FORMULA: C30H46Cl4N4O2
MOLECULAR WEIGHT: 636.52384
SMILES: CC[N+](CC)(CCCNC(=O)C(=O)NCCC[N+](CC)(CC)CC1=CC=CC=C1Cl)CC2=CC=CC=C2Cl.[Cl-].[Cl-]
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Product OPENEYE NAME: (2-chlorophenyl)methyl-[3-[[2-[3-[(2-chlorophenyl)methyl-diethyl-ammonio]propylamino]-2-oxo-acetyl]amino]propyl]-diethyl-ammonium
CAS Name: (2-chlorophenyl)methyl-[3-[[2-[3-[(2-chlorophenyl)methyl-diethylammonio]propylamino]-1,2-dioxoethyl]amino]propyl]-diethylammonium
IUPAC NAME: (2-chlorophenyl)methyl-[3-[[2-[3-[(2-chlorophenyl)methyl-diethylazaniumyl]propylamino]-2-oxoacetyl]amino]propyl]-diethylazanium
SYSTEMATIC NAME: (2-chlorophenyl)methyl-[3-[[2-[3-[(2-chlorophenyl)methyl-diethyl-azaniumyl]propylamino]-2-oxidanylidene-ethanoyl]amino]propyl]-diethyl-azanium
MOLECULAR FORMULA: C30H46Cl2N4O2+2
MOLECULAR WEIGHT: 565.61784
SMILES: CC[N+](CC)(CCCNC(=O)C(=O)NCCC[N+](CC)(CC)CC1=CC=CC=C1Cl)CC2=CC=CC=C2Cl
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Product OPENEYE NAME: benzyl-[2-[[2-[2-[benzyl(diethyl)ammonio]ethylamino]-2-oxo-acetyl]amino]ethyl]-diethyl-ammonium dichloride
CAS Name: 2-[[2-[2-[diethyl-(phenylmethyl)ammonio]ethylamino]-1,2-dioxoethyl]amino]ethyl-diethyl-(phenylmethyl)ammonium dichloride
IUPAC NAME: benzyl-[2-[[2-[2-[benzyl(diethyl)azaniumyl]ethylamino]-2-oxoacetyl]amino]ethyl]-diethylazanium dichloride
SYSTEMATIC NAME: 2-[[2-[2-[diethyl-(phenylmethyl)azaniumyl]ethylamino]-2-oxidanylidene-ethanoyl]amino]ethyl-diethyl-(phenylmethyl)azanium dichloride
MOLECULAR FORMULA: C28H44Cl2N4O2
MOLECULAR WEIGHT: 539.58056
SMILES: CC[N+](CC)(CCNC(=O)C(=O)NCC[N+](CC)(CC)CC1=CC=CC=C1)CC2=CC=CC=C2.[Cl-].[Cl-]
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Product OPENEYE NAME: benzyl-[2-[[2-[2-[benzyl(diethyl)ammonio]ethylamino]-2-oxo-acetyl]amino]ethyl]-diethyl-ammonium
CAS Name: 2-[[2-[2-[diethyl-(phenylmethyl)ammonio]ethylamino]-1,2-dioxoethyl]amino]ethyl-diethyl-(phenylmethyl)ammonium
IUPAC NAME: benzyl-[2-[[2-[2-[benzyl(diethyl)azaniumyl]ethylamino]-2-oxoacetyl]amino]ethyl]-diethylazanium
SYSTEMATIC NAME: 2-[[2-[2-[diethyl-(phenylmethyl)azaniumyl]ethylamino]-2-oxidanylidene-ethanoyl]amino]ethyl-diethyl-(phenylmethyl)azanium
MOLECULAR FORMULA: C28H44N4O2+2
MOLECULAR WEIGHT: 468.67456
SMILES: CC[N+](CC)(CCNC(=O)C(=O)NCC[N+](CC)(CC)CC1=CC=CC=C1)CC2=CC=CC=C2
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Product OPENEYE NAME: (8R,9S,13S,14S,17R)-3-(cyclopentoxy)-17-ethynyl-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-ol
CAS Name: (8R,9S,13S,14S,17R)-3-cyclopentyloxy-17-ethynyl-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-ol
IUPAC NAME: (8R,9S,13S,14S,17R)-3-cyclopentyloxy-17-ethynyl-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-ol
SYSTEMATIC NAME: (8R,9S,13S,14S,17R)-3-cyclopentyloxy-17-ethynyl-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-ol
MOLECULAR FORMULA: C25H32O2
MOLECULAR WEIGHT: 364.52038
SMILES: C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@]2(C#C)O)CCC4=C3C=CC(=C4)OC5CCCC5
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Product OPENEYE NAME: 4-amino-N-(3-methoxypyrazin-2-yl)benzenesulfonamide
CAS Name: 4-amino-N-(3-methoxy-2-pyrazinyl)benzenesulfonamide
IUPAC NAME: 4-amino-N-(3-methoxypyrazin-2-yl)benzenesulfonamide
SYSTEMATIC NAME: 4-azanyl-N-(3-methoxypyrazin-2-yl)benzenesulfonamide
MOLECULAR FORMULA: C11H12N4O3S
MOLECULAR WEIGHT: 280.30298
SMILES: COC1=NC=CN=C1NS(=O)(=O)C2=CC=C(C=C2)N
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Product OPENEYE NAME: 1-(4-chlorophenyl)-6,6-dimethyl-1,3,5-triazine-2,4-diamine hydrochloride
CAS Name: 1-(4-chlorophenyl)-6,6-dimethyl-1,3,5-triazine-2,4-diamine hydrochloride
IUPAC NAME: 1-(4-chlorophenyl)-6,6-dimethyl-1,3,5-triazine-2,4-diamine hydrochloride
SYSTEMATIC NAME: 1-(4-chlorophenyl)-6,6-dimethyl-1,3,5-triazine-2,4-diamine hydrochloride
MOLECULAR FORMULA: C11H15Cl2N5
MOLECULAR WEIGHT: 288.1763
SMILES: CC1(N=C(N=C(N1C2=CC=C(C=C2)Cl)N)N)C.Cl
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Product OPENEYE NAME: 1-(4-chlorophenyl)-6,6-dimethyl-1,3,5-triazine-2,4-diamine
CAS Name: 1-(4-chlorophenyl)-6,6-dimethyl-1,3,5-triazine-2,4-diamine
IUPAC NAME: 1-(4-chlorophenyl)-6,6-dimethyl-1,3,5-triazine-2,4-diamine
SYSTEMATIC NAME: 1-(4-chlorophenyl)-6,6-dimethyl-1,3,5-triazine-2,4-diamine
MOLECULAR FORMULA: C11H14ClN5
MOLECULAR WEIGHT: 251.71536
SMILES: CC1(N=C(N=C(N1C2=CC=C(C=C2)Cl)N)N)C
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Product OPENEYE NAME: (17R)-17-hydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one
CAS Name: (17R)-17-hydroxy-17-(2-hydroxy-1-oxoethyl)-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one
IUPAC NAME: (17R)-17-hydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one
SYSTEMATIC NAME: (17R)-10,13-dimethyl-17-oxidanyl-17-(2-oxidanylethanoyl)-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one
MOLECULAR FORMULA: C21H30O4
MOLECULAR WEIGHT: 346.4605
SMILES: CC12CCC(=O)C=C1CCC3C2CCC4(C3CC[C@@]4(C(=O)CO)O)C
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Product OPENEYE NAME: (8S,9R,10S,13S,14S,17S)-17-acetyl-10,13-dimethyl-1,2,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-one
CAS Name: (8S,9R,10S,13S,14S,17S)-17-acetyl-10,13-dimethyl-1,2,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-one
IUPAC NAME: (8S,9R,10S,13S,14S,17S)-17-acetyl-10,13-dimethyl-1,2,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-one
SYSTEMATIC NAME: (8S,9R,10S,13S,14S,17S)-17-ethanoyl-10,13-dimethyl-1,2,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-one
MOLECULAR FORMULA: C21H28O2
MOLECULAR WEIGHT: 312.44582
SMILES: CC(=O)[C@H]1CC[C@@H]2[C@@]1(CC[C@@H]3[C@H]2C=CC4=CC(=O)CC[C@@]34C)C
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Product OPENEYE NAME: 2-hydroxy-3-[1-(4-nitrophenyl)-3-oxo-butyl]chromen-4-one
CAS Name: 2-hydroxy-3-[1-(4-nitrophenyl)-3-oxobutyl]-1-benzopyran-4-one
IUPAC NAME: 2-hydroxy-3-[1-(4-nitrophenyl)-3-oxobutyl]chromen-4-one
SYSTEMATIC NAME: 3-[1-(4-nitrophenyl)-3-oxidanylidene-butyl]-2-oxidanyl-chromen-4-one
MOLECULAR FORMULA: C19H15NO6
MOLECULAR WEIGHT: 353.3255
SMILES: CC(=O)CC(C1=CC=C(C=C1)[N+](=O)[O-])C2=C(OC3=CC=CC=C3C2=O)O
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Product OPENEYE NAME: (6S,8S,9S,10R,11S,13S,14S,16R,17S)-6-fluoro-11-hydroxy-17-(2-hydroxyacetyl)-10,13,16-trimethyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-one
CAS Name: (6S,8S,9S,10R,11S,13S,14S,16R,17S)-6-fluoro-11-hydroxy-17-(2-hydroxy-1-oxoethyl)-10,13,16-trimethyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-one
IUPAC NAME: (6S,8S,9S,10R,11S,13S,14S,16R,17S)-6-fluoro-11-hydroxy-17-(2-hydroxyacetyl)-10,13,16-trimethyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-one
SYSTEMATIC NAME: (6S,8S,9S,10R,11S,13S,14S,16R,17S)-6-fluoranyl-10,13,16-trimethyl-11-oxidanyl-17-(2-oxidanylethanoyl)-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-one
MOLECULAR FORMULA: C22H29FO4
MOLECULAR WEIGHT: 376.461663
SMILES: C[C@@H]1C[C@H]2[C@@H]3C[C@@H](C4=CC(=O)C=C[C@@]4([C@H]3[C@H](C[C@@]2([C@H]1C(=O)CO)C)O)C)F
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Product OPENEYE NAME: (5S)-17-hydroxy-1,10,13-trimethyl-4,5,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one
CAS Name: (5S)-17-hydroxy-1,10,13-trimethyl-4,5,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one
IUPAC NAME: (5S)-17-hydroxy-1,10,13-trimethyl-4,5,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one
SYSTEMATIC NAME: (5S)-1,10,13-trimethyl-17-oxidanyl-4,5,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one
MOLECULAR FORMULA: C20H30O2
MOLECULAR WEIGHT: 302.451
SMILES: CC1=CC(=O)C[C@H]2C1(C3CCC4(C(C3CC2)CCC4O)C)C
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Product OPENEYE NAME: 5,6,8,9,10,11-hexahydronaphtho[1,2-b]phenanthrene
CAS Name: 5,6,8,9,10,11-hexahydronaphtho[1,2-b]phenanthrene
IUPAC NAME: 5,6,8,9,10,11-hexahydronaphtho[1,2-b]phenanthrene
SYSTEMATIC NAME: 5,6,8,9,10,11-hexahydronaphtho[1,2-b]phenanthrene
MOLECULAR FORMULA: C22H20
MOLECULAR WEIGHT: 284.3942
SMILES: C1CCC2=C(C1)C=CC3=CC4=C(CCC5=CC=CC=C54)C=C23
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Product OPENEYE NAME: 12,13-dihydronaphtho[1,2-b]phenanthrene
CAS Name: 12,13-dihydronaphtho[1,2-b]phenanthrene
IUPAC NAME: 12,13-dihydronaphtho[1,2-b]phenanthrene
SYSTEMATIC NAME: 12,13-dihydronaphtho[1,2-b]phenanthrene
MOLECULAR FORMULA: C22H16
MOLECULAR WEIGHT: 280.36244
SMILES: C1CC2=C(C=C3C=CC4=CC=CC=C4C3=C2)C5=CC=CC=C51
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Product OPENEYE NAME: 8,9,10,11-tetrahydronaphtho[1,2-b]phenanthrene
CAS Name: 8,9,10,11-tetrahydronaphtho[1,2-b]phenanthrene
IUPAC NAME: 8,9,10,11-tetrahydronaphtho[1,2-b]phenanthrene
SYSTEMATIC NAME: 8,9,10,11-tetrahydronaphtho[1,2-b]phenanthrene
MOLECULAR FORMULA: C22H18
MOLECULAR WEIGHT: 282.37832
SMILES: C1CCC2=C(C1)C=CC3=CC4=C(C=CC5=CC=CC=C54)C=C23
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Product OPENEYE NAME: 2-amino-3-[5-[bis(2-chloroethyl)amino]-1H-indol-3-yl]propanoic acid
CAS Name: 2-amino-3-[5-[bis(2-chloroethyl)amino]-1H-indol-3-yl]propanoic acid
IUPAC NAME: 2-amino-3-[5-[bis(2-chloroethyl)amino]-1H-indol-3-yl]propanoic acid
SYSTEMATIC NAME: 2-azanyl-3-[5-[bis(2-chloroethyl)amino]-1H-indol-3-yl]propanoic acid
MOLECULAR FORMULA: C15H19Cl2N3O2
MOLECULAR WEIGHT: 344.23626
SMILES: C1=CC2=C(C=C1N(CCCl)CCCl)C(=CN2)CC(C(=O)O)N
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Product OPENEYE NAME: (2R)-2-amino-3-(1H-indol-3-yl)propanoic acid
CAS Name: (2R)-2-amino-3-(1H-indol-3-yl)propanoic acid
IUPAC NAME: (2R)-2-amino-3-(1H-indol-3-yl)propanoic acid
SYSTEMATIC NAME: (2R)-2-azanyl-3-(1H-indol-3-yl)propanoic acid
MOLECULAR FORMULA: C11H12N2O2
MOLECULAR WEIGHT: 204.22518
SMILES: C1=CC=C2C(=C1)C(=CN2)C[C@H](C(=O)O)N
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Product OPENEYE NAME: 3-(2-hydroxyethyl)-1H-indol-5-ol
CAS Name: 3-(2-hydroxyethyl)-1H-indol-5-ol
IUPAC NAME: 3-(2-hydroxyethyl)-1H-indol-5-ol
SYSTEMATIC NAME: 3-(2-hydroxyethyl)-1H-indol-5-ol
MOLECULAR FORMULA: C10H11NO2
MOLECULAR WEIGHT: 177.19984
SMILES: C1=CC2=C(C=C1O)C(=CN2)CCO
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