CAS RN: 67767-02-6
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C19H25N3O
MOLECULAR WEIGHT: 311.4213
SMILES: CN(C)CCCN1C(=O)CN2C3=C(CCCC3)C4=C2C1=CC=C4
Structure:
CAS RN: 67766-99-8
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C42H56N6O8
MOLECULAR WEIGHT: 772.92944
SMILES: CCN(CC)CCN1C(=O)CN2C3=C(CCC3)C4=C2C1=CC=C4.CCN(CC)CCN1C(=O)CN2C3=C(CCC3)C4=C2C1=CC=C4.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O
Structure:
CAS RN: 67766-97-6
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C18H16N2O
MOLECULAR WEIGHT: 276.33244
SMILES: CC1=C(C2=C3N1CC(=O)N(C3=CC=C2)C)C4=CC=CC=C4
Structure:
CAS RN: 67766-96-5
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C16H15N3O
MOLECULAR WEIGHT: 265.3098
SMILES: C1CCC2=C(C1)C3=C4N2CC(=O)N(C4=CC=C3)CC#N
Structure:
CAS RN: 67766-95-4
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C17H18N2O3
MOLECULAR WEIGHT: 298.33642
SMILES: COC(=O)CN1C(=O)CN2C3=C(CCCC3)C4=C2C1=CC=C4
Structure:
CAS RN: 67766-94-3
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C15H16N2O
MOLECULAR WEIGHT: 240.30034
SMILES: CN1C(=O)CN2C3=C(CCCC3)C4=C2C1=CC=C4
Structure:
CAS RN: 67766-93-2
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C14H14N2O
MOLECULAR WEIGHT: 226.27376
SMILES: CN1C(=O)CN2C3=C(CCC3)C4=C2C1=CC=C4
Structure:
CAS RN: 67755-10-6
CAS Name: 1,1-dioxo-3,4-dihydro-2H-[1,3]thiazino[3,2-b]isoquinolin-6-one
OPENEYE Name: 1,1-dioxo-3,4-dihydro-2H-[1,3]thiazino[3,2-b]isoquinolin-6-one
IUPAC Name: 1,1-dioxo-3,4-dihydro-2H-[1,3]thiazino[3,2-b]isoquinolin-6-one
SYSTEMATIC NAME: 1,1-bis(oxidanylidene)-3,4-dihydro-2H-[1,3]thiazino[3,2-b]isoquinolin-6-one
MOLECULAR FORMULA: C12H11NO3S
MOLECULAR WEIGHT: 249.28564
SMILES: C1CN2C(=CC3=CC=CC=C3C2=O)S(=O)(=O)C1
Structure:
CAS RN: 67755-09-3
CAS Name: 1-oxo-3,4-dihydro-2H-[1,3]thiazino[3,2-b]isoquinolin-6-one
OPENEYE Name: 1-oxo-3,4-dihydro-2H-[1,3]thiazino[3,2-b]isoquinolin-6-one
IUPAC Name: 1-oxo-3,4-dihydro-2H-[1,3]thiazino[3,2-b]isoquinolin-6-one
SYSTEMATIC NAME: 1-oxidanylidene-3,4-dihydro-2H-[1,3]thiazino[3,2-b]isoquinolin-6-one
MOLECULAR FORMULA: C12H11NO2S
MOLECULAR WEIGHT: 233.28624
SMILES: C1CN2C(=CC3=CC=CC=C3C2=O)S(=O)C1
Structure:
CAS RN: 67755-07-1
CAS Name: 1-oxo-2,3-dihydrothiazolo[3,2-b]isoquinolin-5-one
OPENEYE Name: 1-oxo-2,3-dihydrothiazolo[3,2-b]isoquinolin-5-one
IUPAC Name: 1-oxo-2,3-dihydro-[1,3]thiazolo[3,2-b]isoquinolin-5-one
SYSTEMATIC NAME: 1-oxidanylidene-2,3-dihydro-[1,3]thiazolo[3,2-b]isoquinolin-5-one
MOLECULAR FORMULA: C11H9NO2S
MOLECULAR WEIGHT: 219.25966
SMILES: C1CS(=O)C2=CC3=CC=CC=C3C(=O)N21
Structure:
CAS RN: 67755-04-8
CAS Name: 3-methyl-2,3-dihydrothiazolo[3,2-b]isoquinolin-5-one
OPENEYE Name: 3-methyl-2,3-dihydrothiazolo[3,2-b]isoquinolin-5-one
IUPAC Name: 3-methyl-2,3-dihydro-[1,3]thiazolo[3,2-b]isoquinolin-5-one
SYSTEMATIC NAME: 3-methyl-2,3-dihydro-[1,3]thiazolo[3,2-b]isoquinolin-5-one
MOLECULAR FORMULA: C12H11NOS
MOLECULAR WEIGHT: 217.28684
SMILES: CC1CSC2=CC3=CC=CC=C3C(=O)N12
Structure:
CAS RN: 67749-11-5
CAS Name: 2,2-dimethyloctanoic acid hexadecyl ester
OPENEYE Name: hexadecyl 2,2-dimethyloctanoate
IUPAC Name: hexadecyl 2,2-dimethyloctanoate
SYSTEMATIC NAME: hexadecyl 2,2-dimethyloctanoate
MOLECULAR FORMULA: C26H52O2
MOLECULAR WEIGHT: 396.68988
SMILES: CCCCCCCCCCCCCCCCOC(=O)C(C)(C)CCCCCC
Structure:
CAS RN: 67748-98-5
CAS Name: 3-[methoxy(3-pyridinyl)methyl]-1-methyl-2-indolecarboxylic acid hydrochloride
OPENEYE Name: 3-[methoxy(3-pyridyl)methyl]-1-methyl-indole-2-carboxylic acid hydrochloride
IUPAC Name: 3-[methoxy(pyridin-3-yl)methyl]-1-methylindole-2-carboxylic acid hydrochloride
SYSTEMATIC NAME: 3-[methoxy(pyridin-3-yl)methyl]-1-methyl-indole-2-carboxylic acid hydrochloride
MOLECULAR FORMULA: C17H17ClN2O3
MOLECULAR WEIGHT: 332.78148
SMILES: CN1C2=CC=CC=C2C(=C1C(=O)O)C(C3=CN=CC=C3)OC.Cl
Structure:
CAS RN: 67748-97-4
CAS Name: 3-[ethoxy(3-pyridinyl)methyl]-1-methyl-2-indolecarboxylic acid hydrochloride
OPENEYE Name: 3-[ethoxy(3-pyridyl)methyl]-1-methyl-indole-2-carboxylic acid hydrochloride
IUPAC Name: 3-[ethoxy(pyridin-3-yl)methyl]-1-methylindole-2-carboxylic acid hydrochloride
SYSTEMATIC NAME: 3-[ethoxy(pyridin-3-yl)methyl]-1-methyl-indole-2-carboxylic acid hydrochloride
MOLECULAR FORMULA: C18H19ClN2O3
MOLECULAR WEIGHT: 346.80806
SMILES: CCOC(C1=CN=CC=C1)C2=C(N(C3=CC=CC=C32)C)C(=O)O.Cl
Structure:
CAS RN: 67748-91-8
CAS Name: 3-[ethoxy(pyridin-4-yl)methyl]-1-methyl-2-indolecarboxylic acid hydrochloride
OPENEYE Name: 3-[ethoxy(4-pyridyl)methyl]-1-methyl-indole-2-carboxylic acid hydrochloride
IUPAC Name: 3-[ethoxy(pyridin-4-yl)methyl]-1-methylindole-2-carboxylic acid hydrochloride
SYSTEMATIC NAME: 3-[ethoxy(pyridin-4-yl)methyl]-1-methyl-indole-2-carboxylic acid hydrochloride
MOLECULAR FORMULA: C18H19ClN2O3
MOLECULAR WEIGHT: 346.80806
SMILES: CCOC(C1=CC=NC=C1)C2=C(N(C3=CC=CC=C32)C)C(=O)O.Cl
Structure:
CAS RN: 67731-60-6
CAS Name: 4-(2,2-diethyl-5-oxo-1-pyrrolidinyl)benzenesulfonamide
OPENEYE Name: 4-(2,2-diethyl-5-oxo-pyrrolidin-1-yl)benzenesulfonamide
IUPAC Name: 4-(2,2-diethyl-5-oxopyrrolidin-1-yl)benzenesulfonamide
SYSTEMATIC NAME: 4-(2,2-diethyl-5-oxidanylidene-pyrrolidin-1-yl)benzenesulfonamide
MOLECULAR FORMULA: C14H20N2O3S
MOLECULAR WEIGHT: 296.3852
SMILES: CCC1(CCC(=O)N1C2=CC=C(C=C2)S(=O)(=O)N)CC
Structure:
CAS RN: 67726-10-7
CAS Name: 1-[[4-(1,3-benzothiazol-2-yl)-2-thiazolyl]thio]-2-propanone
OPENEYE Name: 1-[4-(1,3-benzothiazol-2-yl)thiazol-2-yl]sulfanylpropan-2-one
IUPAC Name: 1-[[4-(1,3-benzothiazol-2-yl)-1,3-thiazol-2-yl]sulfanyl]propan-2-one
SYSTEMATIC NAME: 1-[[4-(1,3-benzothiazol-2-yl)-1,3-thiazol-2-yl]sulfanyl]propan-2-one
MOLECULAR FORMULA: C13H10N2OS3
MOLECULAR WEIGHT: 306.4263
SMILES: CC(=O)CSC1=NC(=CS1)C2=NC3=CC=CC=C3S2
Structure:
CAS RN: 67724-02-1
CAS Name: 2-[[4-(1,3-benzothiazol-2-yl)-2-thiazolyl]thio]acetic acid ethyl ester
OPENEYE Name: ethyl 2-[4-(1,3-benzothiazol-2-yl)thiazol-2-yl]sulfanylacetate
IUPAC Name: ethyl 2-[[4-(1,3-benzothiazol-2-yl)-1,3-thiazol-2-yl]sulfanyl]acetate
SYSTEMATIC NAME: ethyl 2-[[4-(1,3-benzothiazol-2-yl)-1,3-thiazol-2-yl]sulfanyl]ethanoate
MOLECULAR FORMULA: C14H12N2O2S3
MOLECULAR WEIGHT: 336.45228
SMILES: CCOC(=O)CSC1=NC(=CS1)C2=NC3=CC=CC=C3S2
Structure:
CAS RN: 67724-01-0
CAS Name: 2-[[4-(1,3-benzothiazol-2-yl)-2-thiazolyl]thio]propanoic acid
OPENEYE Name: 2-[4-(1,3-benzothiazol-2-yl)thiazol-2-yl]sulfanylpropanoic acid
IUPAC Name: 2-[[4-(1,3-benzothiazol-2-yl)-1,3-thiazol-2-yl]sulfanyl]propanoic acid
SYSTEMATIC NAME: 2-[[4-(1,3-benzothiazol-2-yl)-1,3-thiazol-2-yl]sulfanyl]propanoic acid
MOLECULAR FORMULA: C13H10N2O2S3
MOLECULAR WEIGHT: 322.4257
SMILES: CC(C(=O)O)SC1=NC(=CS1)C2=NC3=CC=CC=C3S2
Structure:
CAS RN: 67724-00-9
CAS Name: 3-[[4-(1,3-benzothiazol-2-yl)-2-thiazolyl]thio]propanoic acid
OPENEYE Name: 3-[4-(1,3-benzothiazol-2-yl)thiazol-2-yl]sulfanylpropanoic acid
IUPAC Name: 3-[[4-(1,3-benzothiazol-2-yl)-1,3-thiazol-2-yl]sulfanyl]propanoic acid
SYSTEMATIC NAME: 3-[[4-(1,3-benzothiazol-2-yl)-1,3-thiazol-2-yl]sulfanyl]propanoic acid
MOLECULAR FORMULA: C13H10N2O2S3
MOLECULAR WEIGHT: 322.4257
SMILES: C1=CC=C2C(=C1)N=C(S2)C3=CSC(=N3)SCCC(=O)O
Structure:
CAS RN: 67723-99-3
CAS Name: 2-[[4-(1,3-benzothiazol-2-yl)-2-thiazolyl]thio]acetic acid
OPENEYE Name: 2-[4-(1,3-benzothiazol-2-yl)thiazol-2-yl]sulfanylacetic acid
IUPAC Name: 2-[[4-(1,3-benzothiazol-2-yl)-1,3-thiazol-2-yl]sulfanyl]acetic acid
SYSTEMATIC NAME: 2-[[4-(1,3-benzothiazol-2-yl)-1,3-thiazol-2-yl]sulfanyl]ethanoic acid
MOLECULAR FORMULA: C12H8N2O2S3
MOLECULAR WEIGHT: 308.39912
SMILES: C1=CC=C2C(=C1)N=C(S2)C3=CSC(=N3)SCC(=O)O
Structure:
CAS RN: 67723-98-2
CAS Name: benzenecarbothioic acid O-[4-(1,3-benzothiazol-2-yl)-2-thiazolyl] ester
OPENEYE Name: O-[4-(1,3-benzothiazol-2-yl)thiazol-2-yl] benzenecarbothioate
IUPAC Name: O-[4-(1,3-benzothiazol-2-yl)-1,3-thiazol-2-yl] benzenecarbothioate
SYSTEMATIC NAME: O-[4-(1,3-benzothiazol-2-yl)-1,3-thiazol-2-yl] benzenecarbothioate
MOLECULAR FORMULA: C17H10N2OS3
MOLECULAR WEIGHT: 354.4691
SMILES: C1=CC=C(C=C1)C(=S)OC2=NC(=CS2)C3=NC4=CC=CC=C4S3
Structure:
CAS RN: 67723-97-1
CAS Name: ethanethioic acid O-[4-(1,3-benzothiazol-2-yl)-2-thiazolyl] ester
OPENEYE Name: O-[4-(1,3-benzothiazol-2-yl)thiazol-2-yl] ethanethioate
IUPAC Name: O-[4-(1,3-benzothiazol-2-yl)-1,3-thiazol-2-yl] ethanethioate
SYSTEMATIC NAME: O-[4-(1,3-benzothiazol-2-yl)-1,3-thiazol-2-yl] ethanethioate
MOLECULAR FORMULA: C12H8N2OS3
MOLECULAR WEIGHT: 292.39972
SMILES: CC(=S)OC1=NC(=CS1)C2=NC3=CC=CC=C3S2
Structure:
CAS RN: 67723-95-9
CAS Name: 2-[2-(propan-2-ylthio)-4-thiazolyl]-1,3-benzothiazole
OPENEYE Name: 2-(2-isopropylsulfanylthiazol-4-yl)-1,3-benzothiazole
IUPAC Name: 2-(2-propan-2-ylsulfanyl-1,3-thiazol-4-yl)-1,3-benzothiazole
SYSTEMATIC NAME: 2-(2-propan-2-ylsulfanyl-1,3-thiazol-4-yl)-1,3-benzothiazole
MOLECULAR FORMULA: C13H12N2S3
MOLECULAR WEIGHT: 292.44278
SMILES: CC(C)SC1=NC(=CS1)C2=NC3=CC=CC=C3S2
Structure:
CAS RN: 67723-94-8
CAS Name: 2-[2-(propylthio)-4-thiazolyl]-1,3-benzothiazole
OPENEYE Name: 2-(2-propylsulfanylthiazol-4-yl)-1,3-benzothiazole
IUPAC Name: 2-(2-propylsulfanyl-1,3-thiazol-4-yl)-1,3-benzothiazole
SYSTEMATIC NAME: 2-(2-propylsulfanyl-1,3-thiazol-4-yl)-1,3-benzothiazole
MOLECULAR FORMULA: C13H12N2S3
MOLECULAR WEIGHT: 292.44278
SMILES: CCCSC1=NC(=CS1)C2=NC3=CC=CC=C3S2
Structure:
CAS RN: 67723-93-7
CAS Name: 2-[2-(ethylthio)-4-thiazolyl]-1,3-benzothiazole
OPENEYE Name: 2-(2-ethylsulfanylthiazol-4-yl)-1,3-benzothiazole
IUPAC Name: 2-(2-ethylsulfanyl-1,3-thiazol-4-yl)-1,3-benzothiazole
SYSTEMATIC NAME: 2-(2-ethylsulfanyl-1,3-thiazol-4-yl)-1,3-benzothiazole
MOLECULAR FORMULA: C12H10N2S3
MOLECULAR WEIGHT: 278.4162
SMILES: CCSC1=NC(=CS1)C2=NC3=CC=CC=C3S2
Structure:
CAS RN: 67723-92-6
CAS Name: 2-[2-(methylthio)-4-thiazolyl]-1,3-benzothiazole
OPENEYE Name: 2-(2-methylsulfanylthiazol-4-yl)-1,3-benzothiazole
IUPAC Name: 2-(2-methylsulfanyl-1,3-thiazol-4-yl)-1,3-benzothiazole
SYSTEMATIC NAME: 2-(2-methylsulfanyl-1,3-thiazol-4-yl)-1,3-benzothiazole
MOLECULAR FORMULA: C11H8N2S3
MOLECULAR WEIGHT: 264.38962
SMILES: CSC1=NC(=CS1)C2=NC3=CC=CC=C3S2
Structure:
CAS RN: 67704-50-1
CAS Name: 2-[(2-hydroxy-2-phenylethyl)amino]-2-methyl-1-propanol hydrochloride
OPENEYE Name: 2-[(2-hydroxy-2-phenyl-ethyl)amino]-2-methyl-propan-1-ol hydrochloride
IUPAC Name: 2-[(2-hydroxy-2-phenylethyl)amino]-2-methylpropan-1-ol hydrochloride
SYSTEMATIC NAME: 2-methyl-2-[(2-oxidanyl-2-phenyl-ethyl)amino]propan-1-ol hydrochloride
MOLECULAR FORMULA: C12H20ClNO2
MOLECULAR WEIGHT: 245.7457
SMILES: CC(C)(CO)NCC(C1=CC=CC=C1)O.Cl
Structure:
CAS RN: 67681-84-9
CAS Name: 6-chloro-1-ethyl-4-oxo-7-(1-piperazinyl)-3-quinolinecarboxylic acid
OPENEYE Name: 6-chloro-1-ethyl-4-oxo-7-piperazin-1-yl-quinoline-3-carboxylic acid
IUPAC Name: 6-chloro-1-ethyl-4-oxo-7-piperazin-1-ylquinoline-3-carboxylic acid
SYSTEMATIC NAME: 6-chloranyl-1-ethyl-4-oxidanylidene-7-piperazin-1-yl-quinoline-3-carboxylic acid
MOLECULAR FORMULA: C16H18ClN3O3
MOLECULAR WEIGHT: 335.78542
SMILES: CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCNCC3)Cl)C(=O)O
Structure:
CAS RN: 67658-66-6
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C20H28N4O3S
MOLECULAR WEIGHT: 404.52632
SMILES: CN1C[C@@H](C[C@H]2[C@H]1CC3=CNC4=CC=CC2=C34)CNS(=O)(=O)N5CCOCC5
Structure:
CAS RN: 67658-65-5
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C20H26N4O3S
MOLECULAR WEIGHT: 402.51044
SMILES: CN1C[C@@H](C=C2[C@H]1CC3=CNC4=CC=CC2=C34)CNS(=O)(=O)N5CCOCC5
Structure:
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