CAS RN: 3706-30-7
CAS Name: 1-(3,4-dimethoxyphenyl)-N-methoxy-2-propanamine hydrochloride
OPENEYE Name: 1-(3,4-dimethoxyphenyl)-N-methoxy-propan-2-amine hydrochloride
IUPAC Name: 1-(3,4-dimethoxyphenyl)-N-methoxypropan-2-amine hydrochloride
SYSTEMATIC NAME: 1-(3,4-dimethoxyphenyl)-N-methoxy-propan-2-amine hydrochloride
MOLECULAR FORMULA: C12H20ClNO3
MOLECULAR WEIGHT: 261.7451
SMILES: CC(CC1=CC(=C(C=C1)OC)OC)NOC.Cl
Structure:
CAS RN: 3706-28-3
CAS Name: N-methoxy-1-(4-methylphenyl)-2-propanamine hydrochloride
OPENEYE Name: N-methoxy-1-(p-tolyl)propan-2-amine hydrochloride
IUPAC Name: N-methoxy-1-(4-methylphenyl)propan-2-amine hydrochloride
SYSTEMATIC NAME: N-methoxy-1-(4-methylphenyl)propan-2-amine hydrochloride
MOLECULAR FORMULA: C11H18ClNO
MOLECULAR WEIGHT: 215.71972
SMILES: CC1=CC=C(C=C1)CC(C)NOC.Cl
Structure:
CAS RN: 3705-65-5
CAS Name: 2-methyl-2-octoxypropanoic acid 2-(diethylamino)ethyl ester hydrochloride
OPENEYE Name: 2-(diethylamino)ethyl 2-methyl-2-octoxy-propanoate hydrochloride
IUPAC Name: 2-(diethylamino)ethyl 2-methyl-2-octoxypropanoate hydrochloride
SYSTEMATIC NAME: 2-(diethylamino)ethyl 2-methyl-2-octoxy-propanoate hydrochloride
MOLECULAR FORMULA: C18H38ClNO3
MOLECULAR WEIGHT: 351.95222
SMILES: CCCCCCCCOC(C)(C)C(=O)OCCN(CC)CC.Cl
Structure:
CAS RN: 3705-07-5
CAS Name: 2-(4-benzoylphenoxy)-N,N-diethylacetamide
OPENEYE Name: 2-(4-benzoylphenoxy)-N,N-diethyl-acetamide
IUPAC Name: 2-(4-benzoylphenoxy)-N,N-diethylacetamide
SYSTEMATIC NAME: N,N-diethyl-2-[4-(phenylcarbonyl)phenoxy]ethanamide
MOLECULAR FORMULA: C19H21NO3
MOLECULAR WEIGHT: 311.37494
SMILES: CCN(CC)C(=O)COC1=CC=C(C=C1)C(=O)C2=CC=CC=C2
Structure:
CAS RN: 3704-42-5
CAS Name: 4-(4-nitrophenyl)thiazole
OPENEYE Name: 4-(4-nitrophenyl)thiazole
IUPAC Name: 4-(4-nitrophenyl)-1,3-thiazole
SYSTEMATIC NAME: 4-(4-nitrophenyl)-1,3-thiazole
MOLECULAR FORMULA: C9H6N2O2S
MOLECULAR WEIGHT: 206.22114
SMILES: C1=CC(=CC=C1C2=CSC=N2)[N+](=O)[O-]
Structure:
CAS RN: 3695-99-6
CAS Name: 4-(4-chlorophenyl)azo-3-methyl-5-oxo-4H-pyrazole-1-carboximidamide hydrochloride
OPENEYE Name: 4-(4-chlorophenyl)azo-3-methyl-5-oxo-4H-pyrazole-1-carboxamidine hydrochloride
IUPAC Name: 4-[(4-chlorophenyl)diazenyl]-3-methyl-5-oxo-4H-pyrazole-1-carboximidamide hydrochloride
SYSTEMATIC NAME: 4-[(4-chlorophenyl)diazenyl]-3-methyl-5-oxidanylidene-4H-pyrazole-1-carboximidamide hydrochloride
MOLECULAR FORMULA: C11H12Cl2N6O
MOLECULAR WEIGHT: 315.15858
SMILES: CC1=NN(C(=O)C1N=NC2=CC=C(C=C2)Cl)C(=N)N.Cl
Structure:
CAS RN: 3694-54-0
CAS Name: N-diethoxyphosphinothioylaniline
OPENEYE Name: N-diethoxyphosphinothioylaniline
IUPAC Name: N-diethoxyphosphinothioylaniline
SYSTEMATIC NAME: N-diethoxyphosphinothioylaniline
MOLECULAR FORMULA: C10H16NO2PS
MOLECULAR WEIGHT: 245.278301
SMILES: CCOP(=S)(NC1=CC=CC=C1)OCC
Structure:
CAS RN: 3692-87-3
CAS Name: 2-(dimethoxyphosphinothioylthio)acetamide
OPENEYE Name: 2-dimethoxyphosphinothioylsulfanylacetamide
IUPAC Name: 2-dimethoxyphosphinothioylsulfanylacetamide
SYSTEMATIC NAME: 2-dimethoxyphosphinothioylsulfanylethanamide
MOLECULAR FORMULA: C4H10NO3PS2
MOLECULAR WEIGHT: 215.230861
SMILES: COP(=S)(OC)SCC(=O)N
Structure:
CAS RN: 3692-18-0
CAS Name: (1-methylcyclohexyl)urea
OPENEYE Name: (1-methylcyclohexyl)urea
IUPAC Name: (1-methylcyclohexyl)urea
SYSTEMATIC NAME: 1-(1-methylcyclohexyl)urea
MOLECULAR FORMULA: C8H16N2O
MOLECULAR WEIGHT: 156.22544
SMILES: CC1(CCCCC1)NC(=O)N
Structure:
CAS RN: 3690-87-7
CAS Name: acetic acid; 4-[2-[4-(8-amino-5-methyl-6-phenanthridin-5-iumyl)phenyl]iminohydrazinyl]benzenecarboximidamide; chloride
OPENEYE Name: acetic acid; 4-[2-[4-(8-amino-5-methyl-phenanthridin-5-ium-6-yl)phenyl]iminohydrazino]benzamidine; chloride
IUPAC Name: acetic acid; 4-[2-[4-(8-amino-5-methylphenanthridin-5-ium-6-yl)phenyl]iminohydrazinyl]benzenecarboximidamide; chloride
SYSTEMATIC NAME: 4-[2-[4-(8-azanyl-5-methyl-phenanthridin-5-ium-6-yl)phenyl]iminohydrazinyl]benzenecarboximidamide; ethanoic acid; chloride
MOLECULAR FORMULA: C29H28ClN7O2
MOLECULAR WEIGHT: 542.03132
SMILES: CC(=O)O.C[N+]1=C(C2=C(C=CC(=C2)N)C3=CC=CC=C31)C4=CC=C(C=C4)N=NNC5=CC=C(C=C5)C(=N)N.[Cl-]
Structure:
CAS RN: 3689-97-2
CAS Name: N-[1-(1,3-benzodioxol-5-yl)propan-2-yl]propanamide
OPENEYE Name: N-[2-(1,3-benzodioxol-5-yl)-1-methyl-ethyl]propanamide
IUPAC Name: N-[1-(1,3-benzodioxol-5-yl)propan-2-yl]propanamide
SYSTEMATIC NAME: N-[1-(1,3-benzodioxol-5-yl)propan-2-yl]propanamide
MOLECULAR FORMULA: C13H17NO3
MOLECULAR WEIGHT: 235.27898
SMILES: CCC(=O)NC(C)CC1=CC2=C(C=C1)OCO2
Structure:
CAS RN: 3689-38-1
CAS Name: 2-chloro-10-[(1-methyl-3-piperidinyl)methyl]phenothiazine
OPENEYE Name: 2-chloro-10-[(1-methyl-3-piperidyl)methyl]phenothiazine
IUPAC Name: 2-chloro-10-[(1-methylpiperidin-3-yl)methyl]phenothiazine
SYSTEMATIC NAME: 2-chloranyl-10-[(1-methylpiperidin-3-yl)methyl]phenothiazine
MOLECULAR FORMULA: C19H21ClN2S
MOLECULAR WEIGHT: 344.90144
SMILES: CN1CCCC(C1)CN2C3=CC=CC=C3SC4=C2C=C(C=C4)Cl
Structure:
CAS RN: 3688-44-6
CAS Name: 4-hydroxy-N'-propan-2-ylbutanehydrazide
OPENEYE Name: 4-hydroxy-N'-isopropyl-butanehydrazide
IUPAC Name: 4-hydroxy-N'-propan-2-ylbutanehydrazide
SYSTEMATIC NAME: 4-oxidanyl-N'-propan-2-yl-butanehydrazide
MOLECULAR FORMULA: C7H16N2O2
MOLECULAR WEIGHT: 160.21414
SMILES: CC(C)NNC(=O)CCCO
Structure:
CAS RN: 3686-91-7
CAS Name: phosphoric acid 1-chloropropan-2-yl 2,2-dichloroethenyl ethyl ester
OPENEYE Name: (2-chloro-1-methyl-ethyl) 2,2-dichlorovinyl ethyl phosphate
IUPAC Name: 1-chloropropan-2-yl 2,2-dichloroethenyl ethyl phosphate
SYSTEMATIC NAME: 2,2-bis(chloranyl)ethenyl 1-chloranylpropan-2-yl ethyl phosphate
MOLECULAR FORMULA: C7H12Cl3O4P
MOLECULAR WEIGHT: 297.500541
SMILES: CCOP(=O)(OC=C(Cl)Cl)OC(C)CCl
Structure:
CAS RN: 3684-25-1
CAS Name: 3,4,5-trimethoxybenzoic acid [1-(2-phenylethyl)-4-piperidinyl] ester hydrochloride
OPENEYE Name: [1-(2-phenylethyl)-4-piperidyl] 3,4,5-trimethoxybenzoate hydrochloride
IUPAC Name: [1-(2-phenylethyl)piperidin-4-yl] 3,4,5-trimethoxybenzoate hydrochloride
SYSTEMATIC NAME: [1-(2-phenylethyl)piperidin-4-yl] 3,4,5-trimethoxybenzoate hydrochloride
MOLECULAR FORMULA: C23H30ClNO5
MOLECULAR WEIGHT: 435.941
SMILES: COC1=CC(=CC(=C1OC)OC)C(=O)OC2CCN(CC2)CCC3=CC=CC=C3.Cl
Structure:
CAS RN: 3680-05-5
CAS Name: 2-methyl-2-methylsulfinylpropanoic acid
OPENEYE Name: 2-methyl-2-methylsulfinyl-propanoic acid
IUPAC Name: 2-methyl-2-methylsulfinylpropanoic acid
SYSTEMATIC NAME: 2-methyl-2-methylsulfinyl-propanoic acid
MOLECULAR FORMULA: C5H10O3S
MOLECULAR WEIGHT: 150.1961
SMILES: CC(C)(C(=O)O)S(=O)C
Structure:
CAS RN: 3678-67-9
CAS Name: 3,4,5-trimethoxy-N-(pyridin-4-ylmethyl)benzamide
OPENEYE Name: 3,4,5-trimethoxy-N-(4-pyridylmethyl)benzamide
IUPAC Name: 3,4,5-trimethoxy-N-(pyridin-4-ylmethyl)benzamide
SYSTEMATIC NAME: 3,4,5-trimethoxy-N-(pyridin-4-ylmethyl)benzamide
MOLECULAR FORMULA: C16H18N2O4
MOLECULAR WEIGHT: 302.32512
SMILES: COC1=CC(=CC(=C1OC)OC)C(=O)NCC2=CC=NC=C2
Structure:
CAS RN: 6098-76-6
CAS Name: 3,4,5-trimethoxy-N-(pyridin-4-ylmethyl)benzamide
OPENEYE Name: 3,4,5-trimethoxy-N-(4-pyridylmethyl)benzamide
IUPAC Name: 3,4,5-trimethoxy-N-(pyridin-4-ylmethyl)benzamide
SYSTEMATIC NAME: 3,4,5-trimethoxy-N-(pyridin-4-ylmethyl)benzamide
MOLECULAR FORMULA: C16H18N2O4
MOLECULAR WEIGHT: 302.32512
SMILES: COC1=CC(=CC(=C1OC)OC)C(=O)NCC2=CC=NC=C2
Structure:
CAS RN: 3676-80-0
CAS Name: 3-[methyl(2-phenylethyl)amino]-1,1-diphenyl-1-propanol
OPENEYE Name: 3-[methyl(2-phenylethyl)amino]-1,1-diphenyl-propan-1-ol
IUPAC Name: 3-[methyl(2-phenylethyl)amino]-1,1-diphenylpropan-1-ol
SYSTEMATIC NAME: 3-[methyl(2-phenylethyl)amino]-1,1-diphenyl-propan-1-ol
MOLECULAR FORMULA: C24H27NO
MOLECULAR WEIGHT: 345.47728
SMILES: CN(CCC1=CC=CC=C1)CCC(C2=CC=CC=C2)(C3=CC=CC=C3)O
Structure:
CAS RN: 3670-99-3
CAS Name: 3-(1H-indol-3-yl)-1-[2-(4-morpholinyl)ethyl]pyrrolidine-2,5-dione hydrochloride
OPENEYE Name: 3-(1H-indol-3-yl)-1-(2-morpholinoethyl)pyrrolidine-2,5-dione hydrochloride
IUPAC Name: 3-(1H-indol-3-yl)-1-(2-morpholin-4-ylethyl)pyrrolidine-2,5-dione hydrochloride
SYSTEMATIC NAME: 3-(1H-indol-3-yl)-1-(2-morpholin-4-ylethyl)pyrrolidine-2,5-dione hydrochloride
MOLECULAR FORMULA: C18H22ClN3O3
MOLECULAR WEIGHT: 363.83858
SMILES: C1COCCN1CCN2C(=O)CC(C2=O)C3=CNC4=CC=CC=C43.Cl
Structure:
CAS RN: 3670-97-1
CAS Name: 3-(1H-indol-3-yl)-1-[3-(4-morpholinyl)propyl]pyrrolidine-2,5-dione
OPENEYE Name: 3-(1H-indol-3-yl)-1-(3-morpholinopropyl)pyrrolidine-2,5-dione
IUPAC Name: 3-(1H-indol-3-yl)-1-(3-morpholin-4-ylpropyl)pyrrolidine-2,5-dione
SYSTEMATIC NAME: 3-(1H-indol-3-yl)-1-(3-morpholin-4-ylpropyl)pyrrolidine-2,5-dione
MOLECULAR FORMULA: C19H23N3O3
MOLECULAR WEIGHT: 341.40422
SMILES: C1COCCN1CCCN2C(=O)CC(C2=O)C3=CNC4=CC=CC=C43
Structure:
CAS RN: 3670-89-1
CAS Name: 5-ethyl-5-phenyl-1,3,2-dioxathiane 2-oxide
OPENEYE Name: 5-ethyl-5-phenyl-1,3,2-dioxathiane 2-oxide
IUPAC Name: 5-ethyl-5-phenyl-1,3,2-dioxathiane 2-oxide
SYSTEMATIC NAME: 5-ethyl-5-phenyl-1,3,2-dioxathiane 2-oxide
MOLECULAR FORMULA: C11H14O3S
MOLECULAR WEIGHT: 226.29206
SMILES: CCC1(COS(=O)OC1)C2=CC=CC=C2
Structure:
CAS RN: 3670-88-0
CAS Name: 5-butyl-5-ethyl-1,3,2-dioxathiane 2-oxide
OPENEYE Name: 5-butyl-5-ethyl-1,3,2-dioxathiane 2-oxide
IUPAC Name: 5-butyl-5-ethyl-1,3,2-dioxathiane 2-oxide
SYSTEMATIC NAME: 5-butyl-5-ethyl-1,3,2-dioxathiane 2-oxide
MOLECULAR FORMULA: C9H18O3S
MOLECULAR WEIGHT: 206.30242
SMILES: CCCCC1(COS(=O)OC1)CC
Structure:
CAS RN: 3670-87-9
CAS Name: 5-ethyl-5-propyl-1,3,2-dioxathiane 2-oxide
OPENEYE Name: 5-ethyl-5-propyl-1,3,2-dioxathiane 2-oxide
IUPAC Name: 5-ethyl-5-propyl-1,3,2-dioxathiane 2-oxide
SYSTEMATIC NAME: 5-ethyl-5-propyl-1,3,2-dioxathiane 2-oxide
MOLECULAR FORMULA: C8H16O3S
MOLECULAR WEIGHT: 192.27584
SMILES: CCCC1(COS(=O)OC1)CC
Structure:
CAS RN: 3670-86-8
CAS Name: 5,5-diethyl-1,3,2-dioxathiane 2-oxide
OPENEYE Name: 5,5-diethyl-1,3,2-dioxathiane 2-oxide
IUPAC Name: 5,5-diethyl-1,3,2-dioxathiane 2-oxide
SYSTEMATIC NAME: 5,5-diethyl-1,3,2-dioxathiane 2-oxide
MOLECULAR FORMULA: C7H14O3S
MOLECULAR WEIGHT: 178.24926
SMILES: CCC1(COS(=O)OC1)CC
Structure:
CAS RN: 3665-12-1
CAS Name: 4-bromo-N-(3-pyridinyl)benzenesulfonamide
OPENEYE Name: 4-bromo-N-(3-pyridyl)benzenesulfonamide
IUPAC Name: 4-bromo-N-pyridin-3-ylbenzenesulfonamide
SYSTEMATIC NAME: 4-bromanyl-N-pyridin-3-yl-benzenesulfonamide
MOLECULAR FORMULA: C11H9BrN2O2S
MOLECULAR WEIGHT: 313.17036
SMILES: C1=CC(=CN=C1)NS(=O)(=O)C2=CC=C(C=C2)Br
Structure:
CAS RN: 3665-11-0
CAS Name: 4-bromo-N-hydroxy-N-methylbenzenesulfonamide
OPENEYE Name: 4-bromo-N-hydroxy-N-methyl-benzenesulfonamide
IUPAC Name: 4-bromo-N-hydroxy-N-methylbenzenesulfonamide
SYSTEMATIC NAME: 4-bromanyl-N-methyl-N-oxidanyl-benzenesulfonamide
MOLECULAR FORMULA: C7H8BrNO3S
MOLECULAR WEIGHT: 266.11232
SMILES: CN(O)S(=O)(=O)C1=CC=C(C=C1)Br
Structure:
CAS RN: 3665-08-5
CAS Name: 4-(cyanomethyl)benzenesulfonamide
OPENEYE Name: 4-(cyanomethyl)benzenesulfonamide
IUPAC Name: 4-(cyanomethyl)benzenesulfonamide
SYSTEMATIC NAME: 4-(cyanomethyl)benzenesulfonamide
MOLECULAR FORMULA: C8H8N2O2S
MOLECULAR WEIGHT: 196.22632
SMILES: C1=CC(=CC=C1CC#N)S(=O)(=O)N
Structure:
CAS RN: 3656-21-1
CAS Name: 4-(3-chlorophenyl)azo-3-methyl-5-oxo-4H-pyrazole-1-carboximidamide hydrochloride
OPENEYE Name: 4-(3-chlorophenyl)azo-3-methyl-5-oxo-4H-pyrazole-1-carboxamidine hydrochloride
IUPAC Name: 4-[(3-chlorophenyl)diazenyl]-3-methyl-5-oxo-4H-pyrazole-1-carboximidamide hydrochloride
SYSTEMATIC NAME: 4-[(3-chlorophenyl)diazenyl]-3-methyl-5-oxidanylidene-4H-pyrazole-1-carboximidamide hydrochloride
MOLECULAR FORMULA: C11H12Cl2N6O
MOLECULAR WEIGHT: 315.15858
SMILES: CC1=NN(C(=O)C1N=NC2=CC(=CC=C2)Cl)C(=N)N.Cl
Structure:
CAS RN: 3656-18-6
CAS Name: 3-methyl-5-oxo-4-phenyldiazenyl-4H-pyrazole-1-carboximidamide hydrochloride
OPENEYE Name: 3-methyl-5-oxo-4-phenylazo-4H-pyrazole-1-carboxamidine hydrochloride
IUPAC Name: 3-methyl-5-oxo-4-phenyldiazenyl-4H-pyrazole-1-carboximidamide hydrochloride
SYSTEMATIC NAME: 3-methyl-5-oxidanylidene-4-phenyldiazenyl-4H-pyrazole-1-carboximidamide hydrochloride
MOLECULAR FORMULA: C11H13ClN6O
MOLECULAR WEIGHT: 280.71352
SMILES: CC1=NN(C(=O)C1N=NC2=CC=CC=C2)C(=N)N.Cl
Structure:
CAS RN: 3656-17-5
CAS Name: 4-(4-chlorophenyl)azo-3,5-dimethyl-1-pyrazolecarboximidamide hydrochloride
OPENEYE Name: 4-(4-chlorophenyl)azo-3,5-dimethyl-pyrazole-1-carboxamidine hydrochloride
IUPAC Name: 4-[(4-chlorophenyl)diazenyl]-3,5-dimethylpyrazole-1-carboximidamide hydrochloride
SYSTEMATIC NAME: 4-[(4-chlorophenyl)diazenyl]-3,5-dimethyl-pyrazole-1-carboximidamide hydrochloride
MOLECULAR FORMULA: C12H14Cl2N6
MOLECULAR WEIGHT: 313.18576
SMILES: CC1=C(C(=NN1C(=N)N)C)N=NC2=CC=C(C=C2)Cl.Cl
Structure:
CAS RN: 3656-16-4
CAS Name: 4-(3-chlorophenyl)azo-3,5-dimethyl-1-pyrazolecarboximidamide hydrochloride
OPENEYE Name: 4-(3-chlorophenyl)azo-3,5-dimethyl-pyrazole-1-carboxamidine hydrochloride
IUPAC Name: 4-[(3-chlorophenyl)diazenyl]-3,5-dimethylpyrazole-1-carboximidamide hydrochloride
SYSTEMATIC NAME: 4-[(3-chlorophenyl)diazenyl]-3,5-dimethyl-pyrazole-1-carboximidamide hydrochloride
MOLECULAR FORMULA: C12H14Cl2N6
MOLECULAR WEIGHT: 313.18576
SMILES: CC1=C(C(=NN1C(=N)N)C)N=NC2=CC(=CC=C2)Cl.Cl
Structure:
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