Sunday, June 30, 2013

All Chemical Compounds Information




Product OPENEYE NAME: 2-[5-[[6-(1,3-dioxoisoindolin-2-yl)hexyl-ethoxy-phosphoryl]amino]-4-oxo-2-phenyl-1,3-thiazinan-3-yl]acetic acid
CAS Name: 2-[5-[[6-(1,3-dioxo-2-isoindolyl)hexyl-ethoxyphosphoryl]amino]-4-oxo-2-phenyl-1,3-thiazinan-3-yl]acetic acid
IUPAC NAME: 2-[5-[[6-(1,3-dioxoisoindol-2-yl)hexyl-ethoxyphosphoryl]amino]-4-oxo-2-phenyl-1,3-thiazinan-3-yl]acetic acid
SYSTEMATIC NAME: 2-[5-[[6-[1,3-bis(oxidanylidene)isoindol-2-yl]hexyl-ethoxy-phosphoryl]amino]-4-oxidanylidene-2-phenyl-1,3-thiazinan-3-yl]ethanoic acid
MOLECULAR FORMULA: C28H34N3O7PS
MOLECULAR WEIGHT: 587.624221
SMILES: CCOP(=O)(CCCCCCN1C(=O)C2=CC=CC=C2C1=O)NC3CSC(N(C3=O)CC(=O)O)C4=CC=CC=C4
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Product OPENEYE NAME: 2-[3-[[ethoxy(4-phenylbutyl)phosphoryl]amino]-4-oxo-2,3-dihydro-1,5-benzothiazepin-5-yl]acetic acid
CAS Name: 2-[3-[[ethoxy(4-phenylbutyl)phosphoryl]amino]-4-oxo-2,3-dihydro-1,5-benzothiazepin-5-yl]acetic acid
IUPAC NAME: 2-[3-[[ethoxy(4-phenylbutyl)phosphoryl]amino]-4-oxo-2,3-dihydro-1,5-benzothiazepin-5-yl]acetic acid
SYSTEMATIC NAME: 2-[3-[[ethoxy(4-phenylbutyl)phosphoryl]amino]-4-oxidanylidene-2,3-dihydro-1,5-benzothiazepin-5-yl]ethanoic acid
MOLECULAR FORMULA: C23H29N2O5PS
MOLECULAR WEIGHT: 476.525521
SMILES: CCOP(=O)(CCCCC1=CC=CC=C1)NC2CSC3=CC=CC=C3N(C2=O)CC(=O)O
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Product OPENEYE NAME: 3-[[(3-amino-3-carboxy-propyl)disulfanyl]methyl]-2-(1,3-dioxoisoindolin-2-yl)-1,4-dioxo-tetralin-2-carboxylic acid
CAS Name: 3-[[(3-amino-3-carboxypropyl)disulfanyl]methyl]-2-(1,3-dioxo-2-isoindolyl)-1,4-dioxo-3H-naphthalene-2-carboxylic acid
IUPAC NAME: 3-[[(3-amino-3-carboxypropyl)disulfanyl]methyl]-2-(1,3-dioxoisoindol-2-yl)-1,4-dioxo-3H-naphthalene-2-carboxylic acid
SYSTEMATIC NAME: 3-[[(3-azanyl-4-oxidanyl-4-oxidanylidene-butyl)disulfanyl]methyl]-2-[1,3-bis(oxidanylidene)isoindol-2-yl]-1,4-bis(oxidanylidene)-3H-naphthalene-2-carboxylic acid
MOLECULAR FORMULA: C24H20N2O8S2
MOLECULAR WEIGHT: 528.5542
SMILES: C1=CC=C2C(=C1)C(=O)C(C(C2=O)(C(=O)O)N3C(=O)C4=CC=CC=C4C3=O)CSSCCC(C(=O)O)N
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Product OPENEYE NAME: 2-[5-[[ethoxy(4-phenylbutyl)phosphoryl]amino]-4-oxo-1,3-thiazepan-3-yl]acetic acid
CAS Name: 2-[5-[[ethoxy(4-phenylbutyl)phosphoryl]amino]-4-oxo-1,3-thiazepan-3-yl]acetic acid
IUPAC NAME: 2-[5-[[ethoxy(4-phenylbutyl)phosphoryl]amino]-4-oxo-1,3-thiazepan-3-yl]acetic acid
SYSTEMATIC NAME: 2-[5-[[ethoxy(4-phenylbutyl)phosphoryl]amino]-4-oxidanylidene-1,3-thiazepan-3-yl]ethanoic acid
MOLECULAR FORMULA: C19H29N2O5PS
MOLECULAR WEIGHT: 428.482721
SMILES: CCOP(=O)(CCCCC1=CC=CC=C1)NC2CCSCN(C2=O)CC(=O)O
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Product OPENEYE NAME: 2-(4H-thiazin-3-yl)acetic acid
CAS Name: 2-(4H-thiazin-3-yl)acetic acid
IUPAC NAME: 2-(4H-thiazin-3-yl)acetic acid
SYSTEMATIC NAME: 2-(4H-1,2-thiazin-3-yl)ethanoic acid
MOLECULAR FORMULA: C6H7NO2S
MOLECULAR WEIGHT: 157.19028
SMILES: C1C=CSN=C1CC(=O)O
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Product OPENEYE NAME: (3-benzamido-1-methyl-4-phenyl-butoxy)-[[3-(carboxymethyl)-4-oxo-3-phenyl-1,3-thiazinan-3-ium-5-yl]amino]-oxo-phosphonium
CAS Name: (4-benzamido-5-phenylpentan-2-yl)oxy-[[3-(carboxymethyl)-4-oxo-3-phenyl-1,3-thiazinan-3-ium-5-yl]amino]-oxophosphonium
IUPAC NAME: (4-benzamido-5-phenylpentan-2-yl)oxy-[[3-(carboxymethyl)-4-oxo-3-phenyl-1,3-thiazinan-3-ium-5-yl]amino]-oxophosphanium
SYSTEMATIC NAME: (4-benzamido-5-phenyl-pentan-2-yl)oxy-[[3-(2-hydroxy-2-oxoethyl)-4-oxidanylidene-3-phenyl-1,3-thiazinan-3-ium-5-yl]amino]-oxidanylidene-phosphanium
MOLECULAR FORMULA: C30H34N3O6PS+2
MOLECULAR WEIGHT: 595.646221
SMILES: CC(CC(CC1=CC=CC=C1)NC(=O)C2=CC=CC=C2)O[P+](=O)NC3CSC[N+](C3=O)(CC(=O)O)C4=CC=CC=C4
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Product OPENEYE NAME: 2-[5-[[ethoxy(4-phenylbutyl)phosphoryl]amino]-4-oxo-2-phenyl-1,3-thiazinan-3-yl]acetic acid
CAS Name: 2-[5-[[ethoxy(4-phenylbutyl)phosphoryl]amino]-4-oxo-2-phenyl-1,3-thiazinan-3-yl]acetic acid
IUPAC NAME: 2-[5-[[ethoxy(4-phenylbutyl)phosphoryl]amino]-4-oxo-2-phenyl-1,3-thiazinan-3-yl]acetic acid
SYSTEMATIC NAME: 2-[5-[[ethoxy(4-phenylbutyl)phosphoryl]amino]-4-oxidanylidene-2-phenyl-1,3-thiazinan-3-yl]ethanoic acid
MOLECULAR FORMULA: C24H31N2O5PS
MOLECULAR WEIGHT: 490.552101
SMILES: CCOP(=O)(CCCCC1=CC=CC=C1)NC2CSC(N(C2=O)CC(=O)O)C3=CC=CC=C3
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Product OPENEYE NAME: 2-[5-[[6-aminohexyl(hydroxy)phosphoryl]amino]-4-oxo-2-phenyl-1,3-thiazinan-3-yl]acetic acid
CAS Name: 2-[5-[[6-aminohexyl(hydroxy)phosphoryl]amino]-4-oxo-2-phenyl-1,3-thiazinan-3-yl]acetic acid
IUPAC NAME: 2-[5-[[6-aminohexyl(hydroxy)phosphoryl]amino]-4-oxo-2-phenyl-1,3-thiazinan-3-yl]acetic acid
SYSTEMATIC NAME: 2-[5-[[6-azanylhexyl(oxidanyl)phosphoryl]amino]-4-oxidanylidene-2-phenyl-1,3-thiazinan-3-yl]ethanoic acid
MOLECULAR FORMULA: C18H28N3O5PS
MOLECULAR WEIGHT: 429.470781
SMILES: C1C(C(=O)N(C(S1)C2=CC=CC=C2)CC(=O)O)NP(=O)(CCCCCCN)O
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Product OPENEYE NAME: 2-[5-[(1-ethoxycarbonyl-3-phenyl-propyl)amino]-4-oxo-2-phenyl-3H-1,3-thiazin-2-yl]acetic acid
CAS Name: 2-[5-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-4-oxo-2-phenyl-3H-1,3-thiazin-2-yl]acetic acid
IUPAC NAME: 2-[5-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-4-oxo-2-phenyl-3H-1,3-thiazin-2-yl]acetic acid
SYSTEMATIC NAME: 2-[5-[(1-ethoxy-1-oxidanylidene-4-phenyl-butan-2-yl)amino]-4-oxidanylidene-2-phenyl-3H-1,3-thiazin-2-yl]ethanoic acid
MOLECULAR FORMULA: C24H26N2O5S
MOLECULAR WEIGHT: 454.53864
SMILES: CCOC(=O)C(CCC1=CC=CC=C1)NC2=CSC(NC2=O)(CC(=O)O)C3=CC=CC=C3
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Product OPENEYE NAME: 2-[5-[[(2-methyl-1-propanoyloxy-propoxy)-(4-phenylbutyl)phosphoryl]amino]-4-oxo-2-phenyl-1,3-thiazinan-3-yl]acetic acid
CAS Name: 2-[5-[[[2-methyl-1-(1-oxopropoxy)propoxy]-(4-phenylbutyl)phosphoryl]amino]-4-oxo-2-phenyl-1,3-thiazinan-3-yl]acetic acid
IUPAC NAME: 2-[5-[[(2-methyl-1-propanoyloxypropoxy)-(4-phenylbutyl)phosphoryl]amino]-4-oxo-2-phenyl-1,3-thiazinan-3-yl]acetic acid
SYSTEMATIC NAME: 2-[5-[[(2-methyl-1-propanoyloxy-propoxy)-(4-phenylbutyl)phosphoryl]amino]-4-oxidanylidene-2-phenyl-1,3-thiazinan-3-yl]ethanoic acid
MOLECULAR FORMULA: C29H39N2O7PS
MOLECULAR WEIGHT: 590.667921
SMILES: CCC(=O)OC(C(C)C)OP(=O)(CCCCC1=CC=CC=C1)NC2CSC(N(C2=O)CC(=O)O)C3=CC=CC=C3
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Product OPENEYE NAME: 2-(5-amino-4-oxo-1,3-thiazepan-3-yl)acetic acid
CAS Name: 2-(5-amino-4-oxo-1,3-thiazepan-3-yl)acetic acid
IUPAC NAME: 2-(5-amino-4-oxo-1,3-thiazepan-3-yl)acetic acid
SYSTEMATIC NAME: 2-(5-azanyl-4-oxidanylidene-1,3-thiazepan-3-yl)ethanoic acid
MOLECULAR FORMULA: C7H12N2O3S
MOLECULAR WEIGHT: 204.24678
SMILES: C1CSCN(C(=O)C1N)CC(=O)O
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Product OPENEYE NAME: 2-[6-[[ethoxy(4-phenylbutyl)phosphoryl]amino]-5-oxo-1,4-thiazepan-4-yl]acetic acid
CAS Name: 2-[6-[[ethoxy(4-phenylbutyl)phosphoryl]amino]-5-oxo-1,4-thiazepan-4-yl]acetic acid
IUPAC NAME: 2-[6-[[ethoxy(4-phenylbutyl)phosphoryl]amino]-5-oxo-1,4-thiazepan-4-yl]acetic acid
SYSTEMATIC NAME: 2-[6-[[ethoxy(4-phenylbutyl)phosphoryl]amino]-5-oxidanylidene-1,4-thiazepan-4-yl]ethanoic acid
MOLECULAR FORMULA: C19H29N2O5PS
MOLECULAR WEIGHT: 428.482721
SMILES: CCOP(=O)(CCCCC1=CC=CC=C1)NC2CSCCN(C2=O)CC(=O)O
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Product OPENEYE NAME: 2-[5-[[6-aminohexyl(hydroxy)phosphoryl]amino]-4-oxo-2-phenyl-2,5-dihydro-1,3-thiazepin-3-yl]acetic acid
CAS Name: 2-[5-[[6-aminohexyl(hydroxy)phosphoryl]amino]-4-oxo-2-phenyl-2,5-dihydro-1,3-thiazepin-3-yl]acetic acid
IUPAC NAME: 2-[5-[[6-aminohexyl(hydroxy)phosphoryl]amino]-4-oxo-2-phenyl-2,5-dihydro-1,3-thiazepin-3-yl]acetic acid
SYSTEMATIC NAME: 2-[5-[[6-azanylhexyl(oxidanyl)phosphoryl]amino]-4-oxidanylidene-2-phenyl-2,5-dihydro-1,3-thiazepin-3-yl]ethanoic acid
MOLECULAR FORMULA: C19H28N3O5PS
MOLECULAR WEIGHT: 441.481481
SMILES: C1=CC=C(C=C1)C2N(C(=O)C(C=CS2)NP(=O)(CCCCCCN)O)CC(=O)O
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Product OPENEYE NAME: chloro(4-phenylbutyl)phosphinic acid
CAS Name: chloro(4-phenylbutyl)phosphinic acid
IUPAC NAME: chloro(4-phenylbutyl)phosphinic acid
SYSTEMATIC NAME: chloranyl(4-phenylbutyl)phosphinic acid
MOLECULAR FORMULA: C10H14ClO2P
MOLECULAR WEIGHT: 232.643721
SMILES: C1=CC=C(C=C1)CCCCP(=O)(O)Cl
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Product OPENEYE NAME: 2-[5-[[hydroxy(4-phenylbutyl)phosphoryl]amino]-4-oxo-1,3-thiazepan-3-yl]acetic acid
CAS Name: 2-[5-[[hydroxy(4-phenylbutyl)phosphoryl]amino]-4-oxo-1,3-thiazepan-3-yl]acetic acid
IUPAC NAME: 2-[5-[[hydroxy(4-phenylbutyl)phosphoryl]amino]-4-oxo-1,3-thiazepan-3-yl]acetic acid
SYSTEMATIC NAME: 2-[4-oxidanylidene-5-[[oxidanyl(4-phenylbutyl)phosphoryl]amino]-1,3-thiazepan-3-yl]ethanoic acid
MOLECULAR FORMULA: C17H25N2O5PS
MOLECULAR WEIGHT: 400.429561
SMILES: C1CSCN(C(=O)C1NP(=O)(CCCCC2=CC=CC=C2)O)CC(=O)O
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Product OPENEYE NAME: (7-amino-1-methyl-heptoxy)-[[3-(carboxymethyl)-4-oxo-2-phenyl-1,3-thiazinan-5-yl]amino]-oxo-phosphonium
CAS Name: 8-aminooctan-2-yloxy-[[3-(carboxymethyl)-4-oxo-2-phenyl-1,3-thiazinan-5-yl]amino]-oxophosphonium
IUPAC NAME: 8-aminooctan-2-yloxy-[[3-(carboxymethyl)-4-oxo-2-phenyl-1,3-thiazinan-5-yl]amino]-oxophosphanium
SYSTEMATIC NAME: 8-azanyloctan-2-yloxy-[[3-(2-hydroxy-2-oxoethyl)-4-oxidanylidene-2-phenyl-1,3-thiazinan-5-yl]amino]-oxidanylidene-phosphanium
MOLECULAR FORMULA: C20H31N3O5PS+
MOLECULAR WEIGHT: 456.516001
SMILES: CC(CCCCCCN)O[P+](=O)NC1CSC(N(C1=O)CC(=O)O)C2=CC=CC=C2
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Product OPENEYE NAME: 2-[5-(1,3-dioxoisoindolin-2-yl)-4-oxo-1,3-thiazepan-3-yl]acetic acid
CAS Name: 2-[5-(1,3-dioxo-2-isoindolyl)-4-oxo-1,3-thiazepan-3-yl]acetic acid
IUPAC NAME: 2-[5-(1,3-dioxoisoindol-2-yl)-4-oxo-1,3-thiazepan-3-yl]acetic acid
SYSTEMATIC NAME: 2-[5-[1,3-bis(oxidanylidene)isoindol-2-yl]-4-oxidanylidene-1,3-thiazepan-3-yl]ethanoic acid
MOLECULAR FORMULA: C15H14N2O5S
MOLECULAR WEIGHT: 334.34706
SMILES: C1CSCN(C(=O)C1N2C(=O)C3=CC=CC=C3C2=O)CC(=O)O
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Product OPENEYE NAME: chloro-[6-(1,3-dioxoisoindolin-2-yl)hexyl]phosphinic acid
CAS Name: chloro-[6-(1,3-dioxo-2-isoindolyl)hexyl]phosphinic acid
IUPAC NAME: chloro-[6-(1,3-dioxoisoindol-2-yl)hexyl]phosphinic acid
SYSTEMATIC NAME: 6-[1,3-bis(oxidanylidene)isoindol-2-yl]hexyl-chloranyl-phosphinic acid
MOLECULAR FORMULA: C14H17ClNO4P
MOLECULAR WEIGHT: 329.715841
SMILES: C1=CC=C2C(=C1)C(=O)N(C2=O)CCCCCCP(=O)(O)Cl
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