CAS RN: 121221-04-3
CAS Name: N-(6-quinolinyl)-2-(3-triethylsilylpropylamino)acetamide dihydrochloride
OPENEYE Name: N-(6-quinolyl)-2-(3-triethylsilylpropylamino)acetamide dihydrochloride
IUPAC Name: N-quinolin-6-yl-2-(3-triethylsilylpropylamino)acetamide dihydrochloride
SYSTEMATIC NAME: N-quinolin-6-yl-2-(3-triethylsilylpropylamino)ethanamide dihydrochloride
MOLECULAR FORMULA: C20H33Cl2N3OSi
MOLECULAR WEIGHT: 430.48702
SMILES: CC[Si](CC)(CC)CCCNCC(=O)NC1=CC2=C(C=C1)N=CC=C2.Cl.Cl
Structure:
CAS RN: 121221-03-2
CAS Name: N-(5-quinolinyl)-3-(3-triethylsilylpropylamino)propanamide dihydrochloride
OPENEYE Name: N-(5-quinolyl)-3-(3-triethylsilylpropylamino)propanamide dihydrochloride
IUPAC Name: N-quinolin-5-yl-3-(3-triethylsilylpropylamino)propanamide dihydrochloride
SYSTEMATIC NAME: N-quinolin-5-yl-3-(3-triethylsilylpropylamino)propanamide dihydrochloride
MOLECULAR FORMULA: C21H35Cl2N3OSi
MOLECULAR WEIGHT: 444.5136
SMILES: CC[Si](CC)(CC)CCCNCCC(=O)NC1=CC=CC2=C1C=CC=N2.Cl.Cl
Structure:
CAS RN: 121221-02-1
CAS Name: N-(5-quinolinyl)-2-(3-triethylsilylpropylamino)acetamide dihydrochloride
OPENEYE Name: N-(5-quinolyl)-2-(3-triethylsilylpropylamino)acetamide dihydrochloride
IUPAC Name: N-quinolin-5-yl-2-(3-triethylsilylpropylamino)acetamide dihydrochloride
SYSTEMATIC NAME: N-quinolin-5-yl-2-(3-triethylsilylpropylamino)ethanamide dihydrochloride
MOLECULAR FORMULA: C20H33Cl2N3OSi
MOLECULAR WEIGHT: 430.48702
SMILES: CC[Si](CC)(CC)CCCNCC(=O)NC1=CC=CC2=C1C=CC=N2.Cl.Cl
Structure:
CAS RN: 121221-01-0
CAS Name: N-(3-quinolinyl)-2-(3-triethylsilylpropylamino)acetamide dihydrochloride
OPENEYE Name: N-(3-quinolyl)-2-(3-triethylsilylpropylamino)acetamide dihydrochloride
IUPAC Name: N-quinolin-3-yl-2-(3-triethylsilylpropylamino)acetamide dihydrochloride
SYSTEMATIC NAME: N-quinolin-3-yl-2-(3-triethylsilylpropylamino)ethanamide dihydrochloride
MOLECULAR FORMULA: C20H33Cl2N3OSi
MOLECULAR WEIGHT: 430.48702
SMILES: CC[Si](CC)(CC)CCCNCC(=O)NC1=CC2=CC=CC=C2N=C1.Cl.Cl
Structure:
CAS RN: 121213-21-6
CAS Name: (2S)-2-[[2-(carboxymethylthio)-1-oxoethyl]amino]-4-mercaptobutanoic acid
OPENEYE Name: (2S)-2-[[2-(carboxymethylsulfanyl)acetyl]amino]-4-sulfanyl-butanoic acid
IUPAC Name: (2S)-2-[[2-(carboxymethylsulfanyl)acetyl]amino]-4-sulfanylbutanoic acid
SYSTEMATIC NAME: (2S)-2-[2-(2-hydroxy-2-oxoethylsulfanyl)ethanoylamino]-4-sulfanyl-butanoic acid
MOLECULAR FORMULA: C8H13NO5S2
MOLECULAR WEIGHT: 267.32252
SMILES: C(CS)[C@@H](C(=O)O)NC(=O)CSCC(=O)O
Structure:
CAS RN: 121168-73-8
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C13H12FN3O
MOLECULAR WEIGHT: 245.252283
SMILES: C1CC2=C(C=C(C=C2)F)C3=C(C1)C(=O)N=C(N3)N
Structure:
CAS RN: 121140-01-0
CAS Name: 4-hydroxy-6-methoxy-1-oxido-1,2,4-benzotriazin-1-ium-3-imine
OPENEYE Name: 4-hydroxy-6-methoxy-1-oxido-1,2,4-benzotriazin-1-ium-3-imine
IUPAC Name: 4-hydroxy-6-methoxy-1-oxido-1,2,4-benzotriazin-1-ium-3-imine
SYSTEMATIC NAME: 6-methoxy-1-oxidanidyl-4-oxidanyl-1,2,4-benzotriazin-1-ium-3-imine
MOLECULAR FORMULA: C8H8N4O3
MOLECULAR WEIGHT: 208.17412
SMILES: COC1=CC2=C(C=C1)[N+](=NC(=N)N2O)[O-]
Structure:
CAS RN: 121135-28-2
CAS Name: 4-hydroxy-1-oxido-7-prop-2-enoxy-1,2,4-benzotriazin-1-ium-3-imine
OPENEYE Name: 7-allyloxy-4-hydroxy-1-oxido-1,2,4-benzotriazin-1-ium-3-imine
IUPAC Name: 4-hydroxy-1-oxido-7-prop-2-enoxy-1,2,4-benzotriazin-1-ium-3-imine
SYSTEMATIC NAME: 1-oxidanidyl-4-oxidanyl-7-prop-2-enoxy-1,2,4-benzotriazin-1-ium-3-imine
MOLECULAR FORMULA: C10H10N4O3
MOLECULAR WEIGHT: 234.2114
SMILES: C=CCOC1=CC2=C(C=C1)N(C(=N)N=[N+]2[O-])O
Structure:
CAS RN: 121112-81-0
CAS Name: 6-[2-(difluoromethoxy)phenyl]-4-methyl-3-phenyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester
OPENEYE Name: ethyl 6-[2-(difluoromethoxy)phenyl]-4-methyl-3-phenyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylate
IUPAC Name: ethyl 6-[2-(difluoromethoxy)phenyl]-4-methyl-3-phenyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate
SYSTEMATIC NAME: ethyl 6-[2-[bis(fluoranyl)methoxy]phenyl]-4-methyl-3-phenyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate
MOLECULAR FORMULA: C21H20F2N2O3S
MOLECULAR WEIGHT: 418.456906
SMILES: CCOC(=O)C1=C(N(C(=S)NC1C2=CC=CC=C2OC(F)F)C3=CC=CC=C3)C
Structure:
CAS RN: 121112-79-6
CAS Name: 6-[2-(difluoromethoxy)phenyl]-3,4-dimethyl-2-oxo-1,6-dihydropyrimidine-5-carboxylic acid pentyl ester
OPENEYE Name: pentyl 6-[2-(difluoromethoxy)phenyl]-3,4-dimethyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate
IUPAC Name: pentyl 6-[2-(difluoromethoxy)phenyl]-3,4-dimethyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate
SYSTEMATIC NAME: pentyl 6-[2-[bis(fluoranyl)methoxy]phenyl]-3,4-dimethyl-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate
MOLECULAR FORMULA: C19H24F2N2O4
MOLECULAR WEIGHT: 382.401666
SMILES: CCCCCOC(=O)C1=C(N(C(=O)NC1C2=CC=CC=C2OC(F)F)C)C
Structure:
CAS RN: 121112-78-5
CAS Name: 4-[2-(difluoromethoxy)phenyl]-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid pentyl ester
OPENEYE Name: pentyl 4-[2-(difluoromethoxy)phenyl]-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate
IUPAC Name: pentyl 4-[2-(difluoromethoxy)phenyl]-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate
SYSTEMATIC NAME: pentyl 4-[2-[bis(fluoranyl)methoxy]phenyl]-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate
MOLECULAR FORMULA: C18H22F2N2O4
MOLECULAR WEIGHT: 368.375086
SMILES: CCCCCOC(=O)C1=C(NC(=O)NC1C2=CC=CC=C2OC(F)F)C
Structure:
CAS RN: 121112-77-4
CAS Name: 6-[2-(difluoromethoxy)phenyl]-3,4-dimethyl-2-oxo-1,6-dihydropyrimidine-5-carboxylic acid propyl ester
OPENEYE Name: propyl 6-[2-(difluoromethoxy)phenyl]-3,4-dimethyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate
IUPAC Name: propyl 6-[2-(difluoromethoxy)phenyl]-3,4-dimethyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate
SYSTEMATIC NAME: propyl 6-[2-[bis(fluoranyl)methoxy]phenyl]-3,4-dimethyl-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate
MOLECULAR FORMULA: C17H20F2N2O4
MOLECULAR WEIGHT: 354.348506
SMILES: CCCOC(=O)C1=C(N(C(=O)NC1C2=CC=CC=C2OC(F)F)C)C
Structure:
CAS RN: 121112-76-3
CAS Name: 4-[2-(difluoromethoxy)phenyl]-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid propyl ester
OPENEYE Name: propyl 4-[2-(difluoromethoxy)phenyl]-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate
IUPAC Name: propyl 4-[2-(difluoromethoxy)phenyl]-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate
SYSTEMATIC NAME: propyl 4-[2-[bis(fluoranyl)methoxy]phenyl]-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate
MOLECULAR FORMULA: C16H18F2N2O4
MOLECULAR WEIGHT: 340.321926
SMILES: CCCOC(=O)C1=C(NC(=O)NC1C2=CC=CC=C2OC(F)F)C
Structure:
CAS RN: 121083-78-1
CAS Name: 1-amino-10-methyl-9-acridinethione
OPENEYE Name: 1-amino-10-methyl-acridine-9-thione
IUPAC Name: 1-amino-10-methylacridine-9-thione
SYSTEMATIC NAME: 1-azanyl-10-methyl-acridine-9-thione
MOLECULAR FORMULA: C14H12N2S
MOLECULAR WEIGHT: 240.32348
SMILES: CN1C2=C(C(=CC=C2)N)C(=S)C3=CC=CC=C31
Structure:
CAS RN: 121083-77-0
CAS Name: 1-amino-10H-acridine-9-thione
OPENEYE Name: 1-amino-10H-acridine-9-thione
IUPAC Name: 1-amino-10H-acridine-9-thione
SYSTEMATIC NAME: 1-azanyl-10H-acridine-9-thione
MOLECULAR FORMULA: C13H10N2S
MOLECULAR WEIGHT: 226.2969
SMILES: C1=CC=C2C(=C1)C(=S)C3=C(N2)C=CC=C3N
Structure:
CAS RN: 121083-75-8
CAS Name: 4-chloro-10-methyl-1-nitro-9-acridinone
OPENEYE Name: 4-chloro-10-methyl-1-nitro-acridin-9-one
IUPAC Name: 4-chloro-10-methyl-1-nitroacridin-9-one
SYSTEMATIC NAME: 4-chloranyl-10-methyl-1-nitro-acridin-9-one
MOLECULAR FORMULA: C14H9ClN2O3
MOLECULAR WEIGHT: 288.68586
SMILES: CN1C2=CC=CC=C2C(=O)C3=C(C=CC(=C31)Cl)[N+](=O)[O-]
Structure:
CAS RN: 121068-59-5
CAS Name: 1-(3-chlorophenyl)-3-(2-ethenoxyethyl)thiourea
OPENEYE Name: 1-(3-chlorophenyl)-3-(2-vinyloxyethyl)thiourea
IUPAC Name: 1-(3-chlorophenyl)-3-(2-ethenoxyethyl)thiourea
SYSTEMATIC NAME: 1-(3-chlorophenyl)-3-(2-ethenoxyethyl)thiourea
MOLECULAR FORMULA: C11H13ClN2OS
MOLECULAR WEIGHT: 256.75172
SMILES: C=COCCNC(=S)NC1=CC(=CC=C1)Cl
Structure:
CAS RN: 121064-30-0
CAS Name: 1,3,3-trimethyl-4H-isoquinoline hydroiodide
OPENEYE Name: 1,3,3-trimethyl-4H-isoquinoline hydroiodide
IUPAC Name: 1,3,3-trimethyl-4H-isoquinoline hydroiodide
SYSTEMATIC NAME: 1,3,3-trimethyl-4H-isoquinoline hydroiodide
MOLECULAR FORMULA: C12H16IN
MOLECULAR WEIGHT: 301.16661
SMILES: CC1=NC(CC2=CC=CC=C12)(C)C.I
Structure:
CAS RN: 121064-28-6
CAS Name: 4-(6,7-dimethoxy-2,3,3-trimethyl-4H-isoquinolin-2-ium-1-yl)butanenitrile iodide
OPENEYE Name: 4-(6,7-dimethoxy-2,3,3-trimethyl-4H-isoquinolin-2-ium-1-yl)butanenitrile iodide
IUPAC Name: 4-(6,7-dimethoxy-2,3,3-trimethyl-4H-isoquinolin-2-ium-1-yl)butanenitrile iodide
SYSTEMATIC NAME: 4-(6,7-dimethoxy-2,3,3-trimethyl-4H-isoquinolin-2-ium-1-yl)butanenitrile iodide
MOLECULAR FORMULA: C18H25IN2O2
MOLECULAR WEIGHT: 428.30777
SMILES: CC1(CC2=CC(=C(C=C2C(=[N+]1C)CCCC#N)OC)OC)C.[I-]
Structure:
CAS RN: 121064-27-5
CAS Name: 4-(2,3,3-trimethyl-4H-isoquinolin-2-ium-1-yl)butanenitrile iodide
OPENEYE Name: 4-(2,3,3-trimethyl-4H-isoquinolin-2-ium-1-yl)butanenitrile iodide
IUPAC Name: 4-(2,3,3-trimethyl-4H-isoquinolin-2-ium-1-yl)butanenitrile iodide
SYSTEMATIC NAME: 4-(2,3,3-trimethyl-4H-isoquinolin-2-ium-1-yl)butanenitrile iodide
MOLECULAR FORMULA: C16H21IN2
MOLECULAR WEIGHT: 368.25581
SMILES: CC1(CC2=CC=CC=C2C(=[N+]1C)CCCC#N)C.[I-]
Structure:
CAS RN: 121064-20-8
CAS Name: 6,7-dimethoxy-1,2,3,3-tetramethyl-4H-isoquinolin-2-ium iodide
OPENEYE Name: 6,7-dimethoxy-1,2,3,3-tetramethyl-4H-isoquinolin-2-ium iodide
IUPAC Name: 6,7-dimethoxy-1,2,3,3-tetramethyl-4H-isoquinolin-2-ium iodide
SYSTEMATIC NAME: 6,7-dimethoxy-1,2,3,3-tetramethyl-4H-isoquinolin-2-ium iodide
MOLECULAR FORMULA: C15H22INO2
MOLECULAR WEIGHT: 375.24515
SMILES: CC1=[N+](C(CC2=CC(=C(C=C12)OC)OC)(C)C)C.[I-]
Structure:
CAS RN: 121064-18-4
CAS Name: 2-(3,3-dimethyl-4H-isoquinolin-1-yl)-3-phenylpropanamide hydrochloride
OPENEYE Name: 2-(3,3-dimethyl-4H-isoquinolin-1-yl)-3-phenyl-propanamide hydrochloride
IUPAC Name: 2-(3,3-dimethyl-4H-isoquinolin-1-yl)-3-phenylpropanamide hydrochloride
SYSTEMATIC NAME: 2-(3,3-dimethyl-4H-isoquinolin-1-yl)-3-phenyl-propanamide hydrochloride
MOLECULAR FORMULA: C20H23ClN2O
MOLECULAR WEIGHT: 342.86242
SMILES: CC1(CC2=CC=CC=C2C(=N1)C(CC3=CC=CC=C3)C(=O)N)C.Cl
Structure:
CAS RN: 121064-16-2
CAS Name: 2-(3,3-dimethyl-4H-isoquinolin-1-yl)-3-methylbutanamide hydrochloride
OPENEYE Name: 2-(3,3-dimethyl-4H-isoquinolin-1-yl)-3-methyl-butanamide hydrochloride
IUPAC Name: 2-(3,3-dimethyl-4H-isoquinolin-1-yl)-3-methylbutanamide hydrochloride
SYSTEMATIC NAME: 2-(3,3-dimethyl-4H-isoquinolin-1-yl)-3-methyl-butanamide hydrochloride
MOLECULAR FORMULA: C16H23ClN2O
MOLECULAR WEIGHT: 294.81962
SMILES: CC(C)C(C1=NC(CC2=CC=CC=C21)(C)C)C(=O)N.Cl
Structure:
CAS RN: 121051-64-7
CAS Name: 1-[4-(1-azoniabicyclo[3.1.0]hexan-1-yl)but-2-ynyl]-2-pyrrolidinone chloride
OPENEYE Name: 1-[4-(1-azoniabicyclo[3.1.0]hexan-1-yl)but-2-ynyl]pyrrolidin-2-one chloride
IUPAC Name: 1-[4-(1-azoniabicyclo[3.1.0]hexan-1-yl)but-2-ynyl]pyrrolidin-2-one chloride
SYSTEMATIC NAME: 1-[4-(1-azoniabicyclo[3.1.0]hexan-1-yl)but-2-ynyl]pyrrolidin-2-one chloride
MOLECULAR FORMULA: C13H19ClN2O
MOLECULAR WEIGHT: 254.75576
SMILES: C1CC2C[N+]2(C1)CC#CCN3CCCC3=O.[Cl-]
Structure:
CAS RN: 121051-65-8
CAS Name: 1-[4-(1-azoniabicyclo[3.1.0]hexan-1-yl)but-2-ynyl]-2-pyrrolidinone chloride
OPENEYE Name: 1-[4-(1-azoniabicyclo[3.1.0]hexan-1-yl)but-2-ynyl]pyrrolidin-2-one chloride
IUPAC Name: 1-[4-(1-azoniabicyclo[3.1.0]hexan-1-yl)but-2-ynyl]pyrrolidin-2-one chloride
SYSTEMATIC NAME: 1-[4-(1-azoniabicyclo[3.1.0]hexan-1-yl)but-2-ynyl]pyrrolidin-2-one chloride
MOLECULAR FORMULA: C13H19ClN2O
MOLECULAR WEIGHT: 254.75576
SMILES: C1CC2C[N+]2(C1)CC#CCN3CCCC3=O.[Cl-]
Structure:
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