CAS RN: 67931-64-0
CAS Name: 2-[3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-2-phenylimino-5-thiazolidinyl]acetic acid
OPENEYE Name: 2-[3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-2-phenylimino-thiazolidin-5-yl]acetic acid
IUPAC Name: 2-[3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-2-phenylimino-1,3-thiazolidin-5-yl]acetic acid
SYSTEMATIC NAME: 2-[3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxidanylidene-2-phenylimino-1,3-thiazolidin-5-yl]ethanoic acid
MOLECULAR FORMULA: C21H22N2O5S
MOLECULAR WEIGHT: 414.47478
SMILES: COC1=C(C=C(C=C1)CCN2C(=O)C(SC2=NC3=CC=CC=C3)CC(=O)O)OC
Structure:
CAS RN: 67918-90-5
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C44H60N6O12
MOLECULAR WEIGHT: 864.9802
SMILES: CCN(CC)CCN1C(=O)CN2C(=C(C3=C2C1=CC=C3)C(=O)OCC)C.CCN(CC)CCN1C(=O)CN2C(=C(C3=C2C1=CC=C3)C(=O)OCC)C.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O
Structure:
CAS RN: 67918-88-1
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C50H60N6O8
MOLECULAR WEIGHT: 873.0468
SMILES: CCN(CC)CCN1C(=O)CN2C(=C(C3=C2C1=CC=C3)C4=CC=CC=C4)C.CCN(CC)CCN1C(=O)CN2C(=C(C3=C2C1=CC=C3)C4=CC=CC=C4)C.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O
Structure:
CAS RN: 67918-87-0
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C23H27N3O
MOLECULAR WEIGHT: 361.47998
SMILES: CCN(CC)CCN1C(=O)CN2C(=C(C3=C2C1=CC=C3)C4=CC=CC=C4)C
Structure:
CAS RN: 67916-95-4
CAS Name: 3-[(2,2-diacetylhydrazinyl)-oxomethoxy]-8-azabicyclo[3.2.1]octane-8-carboxylic acid phenyl ester
OPENEYE Name: phenyl 3-[(diacetylamino)carbamoyloxy]-8-azabicyclo[3.2.1]octane-8-carboxylate
IUPAC Name: phenyl 3-[(diacetylamino)carbamoyloxy]-8-azabicyclo[3.2.1]octane-8-carboxylate
SYSTEMATIC NAME: phenyl 3-[(diethanoylamino)carbamoyloxy]-8-azabicyclo[3.2.1]octane-8-carboxylate
MOLECULAR FORMULA: C19H23N3O6
MOLECULAR WEIGHT: 389.40242
SMILES: CC(=O)N(C(=O)C)NC(=O)OC1CC2CCC(C1)N2C(=O)OC3=CC=CC=C3
Structure:
CAS RN: 67916-84-1
CAS Name: 3-(hydrazinecarbonyloxy)-8-azabicyclo[3.2.1]octane-8-carboxylic acid ethyl ester hydrochloride
OPENEYE Name: ethyl 3-(hydrazinecarbonyloxy)-8-azabicyclo[3.2.1]octane-8-carboxylate hydrochloride
IUPAC Name: ethyl 3-(hydrazinecarbonyloxy)-8-azabicyclo[3.2.1]octane-8-carboxylate hydrochloride
SYSTEMATIC NAME: ethyl 3-(aminocarbamoyloxy)-8-azabicyclo[3.2.1]octane-8-carboxylate hydrochloride
MOLECULAR FORMULA: C11H20ClN3O4
MOLECULAR WEIGHT: 293.7472
SMILES: CCOC(=O)N1C2CCC1CC(C2)OC(=O)NN.Cl
Structure:
CAS RN: 67897-48-7
CAS Name: 2-[2-(diphenylmethylene)hydrazinyl]-1-(10-phenothiazinyl)ethanone
OPENEYE Name: 2-(2-benzhydrylidenehydrazino)-1-phenothiazin-10-yl-ethanone
IUPAC Name: 2-(2-benzhydrylidenehydrazinyl)-1-phenothiazin-10-ylethanone
SYSTEMATIC NAME: 2-[2-(diphenylmethylidene)hydrazinyl]-1-phenothiazin-10-yl-ethanone
MOLECULAR FORMULA: C27H21N3OS
MOLECULAR WEIGHT: 435.54014
SMILES: C1=CC=C(C=C1)C(=NNCC(=O)N2C3=CC=CC=C3SC4=CC=CC=C42)C5=CC=CC=C5
Structure:
CAS RN: 67883-93-6
CAS Name: (2S)-2,6-diaminohexanoic acid; 4-hydroxy-3-(3-methyl-1-oxobut-2-enyl)-2H-furan-5-one
OPENEYE Name: (2S)-2,6-diaminohexanoic acid; 4-hydroxy-3-(3-methylbut-2-enoyl)-2H-furan-5-one
IUPAC Name: (2S)-2,6-diaminohexanoic acid; 4-hydroxy-3-(3-methylbut-2-enoyl)-2H-furan-5-one
SYSTEMATIC NAME: (2S)-2,6-bis(azanyl)hexanoic acid; 3-(3-methylbut-2-enoyl)-4-oxidanyl-2H-furan-5-one
MOLECULAR FORMULA: C15H24N2O6
MOLECULAR WEIGHT: 328.36086
SMILES: CC(=CC(=O)C1=C(C(=O)OC1)O)C.C(CCN)C[C@@H](C(=O)O)N
Structure:
CAS RN: 67877-79-6
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C18H22N2O
MOLECULAR WEIGHT: 282.38008
SMILES: CN1CCC2=C3C1CCC(N3C4=CC=CC=C24)(CC=C)O
Structure:
CAS RN: 67877-77-4
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C17H17ClN2O
MOLECULAR WEIGHT: 300.78268
SMILES: C#CCN1CCC2=C3C1CCC(=O)N3C4=CC=CC=C24.Cl
Structure:
CAS RN: 67877-74-1
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C15H18N2
MOLECULAR WEIGHT: 226.31682
SMILES: CN1CCC2=C3C1CCCN3C4=CC=CC=C24
Structure:
CAS RN: 67877-73-0
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C15H17ClN2O
MOLECULAR WEIGHT: 276.76128
SMILES: CN1CCC2=C3C1CCC(=O)N3C4=CC=CC=C24.Cl
Structure:
CAS RN: 67877-72-9
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C17H19ClN2O
MOLECULAR WEIGHT: 302.79856
SMILES: C=CCN1CCC2=C3C1CCC(=O)N3C4=CC=CC=C24.Cl
Structure:
CAS RN: 67855-53-2
CAS Name: (6R,7R)-7-[[2-(5-ethyl-2-nitro-1-imidazolyl)-1-oxoethyl]amino]-3-[[(5-methyl-1,3,4-thiadiazol-2-yl)thio]methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
OPENEYE Name: (6R,7R)-7-[[2-(5-ethyl-2-nitro-imidazol-1-yl)acetyl]amino]-3-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
IUPAC Name: (6R,7R)-7-[[2-(5-ethyl-2-nitroimidazol-1-yl)acetyl]amino]-3-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
SYSTEMATIC NAME: (6R,7R)-7-[2-(5-ethyl-2-nitro-imidazol-1-yl)ethanoylamino]-3-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
MOLECULAR FORMULA: C18H19N7O6S3
MOLECULAR WEIGHT: 525.58176
SMILES: CCC1=CN=C(N1CC(=O)N[C@H]2[C@@H]3N(C2=O)C(=C(CS3)CSC4=NN=C(S4)C)C(=O)O)[N+](=O)[O-]
Structure:
CAS RN: 67855-52-1
CAS Name: (6R,7R)-3-(acetyloxymethyl)-7-[[2-(5-ethyl-2-nitro-1-imidazolyl)-1-oxoethyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
OPENEYE Name: (6R,7R)-3-(acetoxymethyl)-7-[[2-(5-ethyl-2-nitro-imidazol-1-yl)acetyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
IUPAC Name: (6R,7R)-3-(acetyloxymethyl)-7-[[2-(5-ethyl-2-nitroimidazol-1-yl)acetyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
SYSTEMATIC NAME: (6R,7R)-3-(acetyloxymethyl)-7-[2-(5-ethyl-2-nitro-imidazol-1-yl)ethanoylamino]-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
MOLECULAR FORMULA: C17H19N5O8S
MOLECULAR WEIGHT: 453.42646
SMILES: CCC1=CN=C(N1CC(=O)N[C@H]2[C@@H]3N(C2=O)C(=C(CS3)COC(=O)C)C(=O)O)[N+](=O)[O-]
Structure:
CAS RN: 67848-81-1
CAS Name: N-[[3-hydroxy-5-(hydroxymethyl)-2-methyl-4-pyridinyl]methyl]carbamothioic acid S-[[[[3-hydroxy-5-(hydroxymethyl)-2-methyl-4-pyridinyl]methylamino]-oxomethyl]thio] ester
OPENEYE Name: S-[[3-hydroxy-5-(hydroxymethyl)-2-methyl-4-pyridyl]methylcarbamoylsulfanyl] N-[[3-hydroxy-5-(hydroxymethyl)-2-methyl-4-pyridyl]methyl]carbamothioate
IUPAC Name: S-[[3-hydroxy-5-(hydroxymethyl)-2-methylpyridin-4-yl]methylcarbamoylsulfanyl] N-[[3-hydroxy-5-(hydroxymethyl)-2-methylpyridin-4-yl]methyl]carbamothioate
SYSTEMATIC NAME: S-[[5-(hydroxymethyl)-2-methyl-3-oxidanyl-pyridin-4-yl]methylcarbamoylsulfanyl] N-[[5-(hydroxymethyl)-2-methyl-3-oxidanyl-pyridin-4-yl]methyl]carbamothioate
MOLECULAR FORMULA: C18H22N4O6S2
MOLECULAR WEIGHT: 454.52048
SMILES: CC1=NC=C(C(=C1O)CNC(=O)SSC(=O)NCC2=C(C(=NC=C2CO)C)O)CO
Structure:
CAS RN: 67818-78-4
CAS Name: N-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-3,4,5-trimethoxy-N-methylbenzamide
OPENEYE Name: N-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-3,4,5-trimethoxy-N-methyl-benzamide
IUPAC Name: N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-3,4,5-trimethoxy-N-methylbenzamide
SYSTEMATIC NAME: N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-3,4,5-trimethoxy-N-methyl-benzamide
MOLECULAR FORMULA: C22H25N3O5
MOLECULAR WEIGHT: 411.451
SMILES: CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N(C)C(=O)C3=CC(=C(C(=C3)OC)OC)OC
Structure:
CAS RN: 67806-02-4
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C40H53NO14
MOLECULAR WEIGHT: 771.84712
SMILES: CCN1C[C@@]2([C@@H](C[C@@H](C34[C@@H]2[C@H](C(C31)[C@@]5([C@@H]6[C@@H]4C[C@]([C@@H]6OC(=O)C7=CC=CC=C7)([C@H]([C@@H]5OC(=O)C)OC)OC(=O)C)OC(=O)C)OC)OC)OC(=O)C)COC
Structure:
CAS RN: 67806-01-3
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C26H35NO5
MOLECULAR WEIGHT: 441.5598
SMILES: CCN1CC2(CCC(C34C2CC(C31)C56C4CC(=O)C(C5)C(=C)C6OC(=O)C)OC(=O)C)C
Structure:
CAS RN: 67800-52-6
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C44H60N6O8
MOLECULAR WEIGHT: 800.9826
SMILES: CCN(CC)CCN1C(=O)CN2C3=C(CCCC3)C4=C2C1=CC=C4.CCN(CC)CCN1C(=O)CN2C3=C(CCCC3)C4=C2C1=CC=C4.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O
Structure:
CAS RN: 67799-29-5
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C16H16N2O3
MOLECULAR WEIGHT: 284.30984
SMILES: COC(=O)CN1C(=O)CN2C3=C(CCC3)C4=C2C1=CC=C4
Structure:
CAS RN: 67799-28-4
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C20H27N3O
MOLECULAR WEIGHT: 325.44788
SMILES: CCN(CC)CCN1C(=O)CN2C3=C(CCCC3)C4=C2C1=CC=C4
Structure:
CAS RN: 67792-88-5
CAS Name: (2S)-2-[carbamoyl(nitroso)amino]pentanedioic acid
OPENEYE Name: (2S)-2-[carbamoyl(nitroso)amino]pentanedioic acid
IUPAC Name: (2S)-2-[carbamoyl(nitroso)amino]pentanedioic acid
SYSTEMATIC NAME: (2S)-2-[aminocarbonyl(nitroso)amino]pentanedioic acid
MOLECULAR FORMULA: C6H9N3O6
MOLECULAR WEIGHT: 219.15216
SMILES: C(CC(=O)O)[C@@H](C(=O)O)N(C(=O)N)N=O
Structure:
CAS RN: 67792-87-4
CAS Name: (2S)-2-[carbamoyl(nitroso)amino]pentanedioic acid diethyl ester
OPENEYE Name: diethyl (2S)-2-[carbamoyl(nitroso)amino]pentanedioate
IUPAC Name: diethyl (2S)-2-[carbamoyl(nitroso)amino]pentanedioate
SYSTEMATIC NAME: diethyl (2S)-2-[aminocarbonyl(nitroso)amino]pentanedioate
MOLECULAR FORMULA: C10H17N3O6
MOLECULAR WEIGHT: 275.25848
SMILES: CCOC(=O)CC[C@@H](C(=O)OCC)N(C(=O)N)N=O
Structure:
CAS RN: 67792-86-3
CAS Name: (2S)-2-[carbamoyl(nitroso)amino]-3-methylbutanoic acid ethyl ester
OPENEYE Name: ethyl (2S)-2-[carbamoyl(nitroso)amino]-3-methyl-butanoate
IUPAC Name: ethyl (2S)-2-[carbamoyl(nitroso)amino]-3-methylbutanoate
SYSTEMATIC NAME: ethyl (2S)-2-[aminocarbonyl(nitroso)amino]-3-methyl-butanoate
MOLECULAR FORMULA: C8H15N3O4
MOLECULAR WEIGHT: 217.2224
SMILES: CCOC(=O)[C@H](C(C)C)N(C(=O)N)N=O
Structure:
CAS RN: 67792-10-3
CAS Name: 4-[1-phenyl-3-(1-phenylpropan-2-ylamino)propyl]phenol hydrochloride
OPENEYE Name: 4-[3-[(1-methyl-2-phenyl-ethyl)amino]-1-phenyl-propyl]phenol hydrochloride
IUPAC Name: 4-[1-phenyl-3-(1-phenylpropan-2-ylamino)propyl]phenol hydrochloride
SYSTEMATIC NAME: 4-[1-phenyl-3-(1-phenylpropan-2-ylamino)propyl]phenol hydrochloride
MOLECULAR FORMULA: C24H28ClNO
MOLECULAR WEIGHT: 381.93822
SMILES: CC(CC1=CC=CC=C1)NCCC(C2=CC=CC=C2)C3=CC=C(C=C3)O.Cl
Structure:
CAS RN: 67792-03-4
CAS Name: 2-[1-phenyl-3-(1-phenylpropan-2-ylamino)propyl]phenol hydrochloride
OPENEYE Name: 2-[3-[(1-methyl-2-phenyl-ethyl)amino]-1-phenyl-propyl]phenol hydrochloride
IUPAC Name: 2-[1-phenyl-3-(1-phenylpropan-2-ylamino)propyl]phenol hydrochloride
SYSTEMATIC NAME: 2-[1-phenyl-3-(1-phenylpropan-2-ylamino)propyl]phenol hydrochloride
MOLECULAR FORMULA: C24H28ClNO
MOLECULAR WEIGHT: 381.93822
SMILES: CC(CC1=CC=CC=C1)NCCC(C2=CC=CC=C2)C3=CC=CC=C3O.Cl
Structure:
CAS RN: 67770-80-3
CAS Name: 2-(3-methoxyphenyl)-3-methyloxazolidine
OPENEYE Name: 2-(3-methoxyphenyl)-3-methyl-oxazolidine
IUPAC Name: 2-(3-methoxyphenyl)-3-methyl-1,3-oxazolidine
SYSTEMATIC NAME: 2-(3-methoxyphenyl)-3-methyl-1,3-oxazolidine
MOLECULAR FORMULA: C11H15NO2
MOLECULAR WEIGHT: 193.2423
SMILES: CN1CCOC1C2=CC(=CC=C2)OC
Structure:
CAS RN: 67767-32-2
CAS Name: 6-hydroxy-1-(4-methoxyphenyl)-5,6-dimethyl-1,3-diazinane-2-thione
OPENEYE Name: 6-hydroxy-1-(4-methoxyphenyl)-5,6-dimethyl-hexahydropyrimidine-2-thione
IUPAC Name: 6-hydroxy-1-(4-methoxyphenyl)-5,6-dimethyl-1,3-diazinane-2-thione
SYSTEMATIC NAME: 1-(4-methoxyphenyl)-5,6-dimethyl-6-oxidanyl-1,3-diazinane-2-thione
MOLECULAR FORMULA: C13H18N2O2S
MOLECULAR WEIGHT: 266.35922
SMILES: CC1CNC(=S)N(C1(C)O)C2=CC=C(C=C2)OC
Structure:
CAS RN: 67767-31-1
CAS Name: 6-hydroxy-5,6-dimethyl-1-(4-methylphenyl)-1,3-diazinane-2-thione
OPENEYE Name: 6-hydroxy-5,6-dimethyl-1-(p-tolyl)hexahydropyrimidine-2-thione
IUPAC Name: 6-hydroxy-5,6-dimethyl-1-(4-methylphenyl)-1,3-diazinane-2-thione
SYSTEMATIC NAME: 5,6-dimethyl-1-(4-methylphenyl)-6-oxidanyl-1,3-diazinane-2-thione
MOLECULAR FORMULA: C13H18N2OS
MOLECULAR WEIGHT: 250.35982
SMILES: CC1CNC(=S)N(C1(C)O)C2=CC=C(C=C2)C
Structure:
CAS RN: 67767-29-7
CAS Name: 1-butan-2-yl-6-hydroxy-4,4,6-trimethyl-1,3-diazinane-2-thione
OPENEYE Name: 6-hydroxy-4,4,6-trimethyl-1-sec-butyl-hexahydropyrimidine-2-thione
IUPAC Name: 1-butan-2-yl-6-hydroxy-4,4,6-trimethyl-1,3-diazinane-2-thione
SYSTEMATIC NAME: 1-butan-2-yl-4,4,6-trimethyl-6-oxidanyl-1,3-diazinane-2-thione
MOLECULAR FORMULA: C11H22N2OS
MOLECULAR WEIGHT: 230.37018
SMILES: CCC(C)N1C(=S)NC(CC1(C)O)(C)C
Structure:
CAS RN: 67767-28-6
CAS Name: 6-hydroxy-4,4,6-trimethyl-1-propan-2-yl-1,3-diazinane-2-thione
OPENEYE Name: 6-hydroxy-1-isopropyl-4,4,6-trimethyl-hexahydropyrimidine-2-thione
IUPAC Name: 6-hydroxy-4,4,6-trimethyl-1-propan-2-yl-1,3-diazinane-2-thione
SYSTEMATIC NAME: 4,4,6-trimethyl-6-oxidanyl-1-propan-2-yl-1,3-diazinane-2-thione
MOLECULAR FORMULA: C10H20N2OS
MOLECULAR WEIGHT: 216.3436
SMILES: CC(C)N1C(=S)NC(CC1(C)O)(C)C
Structure:
CAS RN: 67767-06-0
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C60H64N6O8
MOLECULAR WEIGHT: 997.18556
SMILES: CCN(CC)CCN1C(=O)CN2C(=C(C3=C2C1=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5.CCN(CC)CCN1C(=O)CN2C(=C(C3=C2C1=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O
Structure:
CAS RN: 67767-05-9
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C28H29N3O
MOLECULAR WEIGHT: 423.54936
SMILES: CCN(CC)CCN1C(=O)CN2C(=C(C3=C2C1=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5
Structure:
CAS RN: 67767-04-8
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C40H56N6O8
MOLECULAR WEIGHT: 748.90804
SMILES: CCN(CC)CCN1C(=O)CN2C(=C(C3=C2C1=CC=C3)C)C.CCN(CC)CCN1C(=O)CN2C(=C(C3=C2C1=CC=C3)C)C.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O
Structure:
No comments:
Post a Comment