CAS RN: 131729-17-4
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C12H10BrNO2S
MOLECULAR WEIGHT: 312.1823
SMILES: C1=CC2=C3C(=C1)N(S(=O)(=O)C3=CC=C2)CCBr
Structure:
CAS RN: 22365-19-1
CAS Name: 6-amino-5-(2-chloro-1-oxoethyl)-1-methylpyrimidine-2,4-dione
OPENEYE Name: 6-amino-5-(2-chloroacetyl)-1-methyl-pyrimidine-2,4-dione
IUPAC Name: 6-amino-5-(2-chloroacetyl)-1-methylpyrimidine-2,4-dione
SYSTEMATIC NAME: 6-azanyl-5-(2-chloranylethanoyl)-1-methyl-pyrimidine-2,4-dione
MOLECULAR FORMULA: C7H8ClN3O3
MOLECULAR WEIGHT: 217.60972
SMILES: CN1C(=C(C(=O)NC1=O)C(=O)CCl)N
Structure:
CAS RN: 55899-42-8
CAS Name: N2-propylbenzene-1,2-diamine
OPENEYE Name: N2-propylbenzene-1,2-diamine
IUPAC Name: 2-N-propylbenzene-1,2-diamine
SYSTEMATIC NAME: N2-propylbenzene-1,2-diamine
MOLECULAR FORMULA: C9H14N2
MOLECULAR WEIGHT: 150.22086
SMILES: CCCNC1=CC=CC=C1N
Structure:
CAS RN: 31112-90-0
CAS Name: 2-[2-(3-pyridinyl)-4-thiazolyl]acetic acid
OPENEYE Name: 2-[2-(3-pyridyl)thiazol-4-yl]acetic acid
IUPAC Name: 2-(2-pyridin-3-yl-1,3-thiazol-4-yl)acetic acid
SYSTEMATIC NAME: 2-(2-pyridin-3-yl-1,3-thiazol-4-yl)ethanoic acid
MOLECULAR FORMULA: C10H8N2O2S
MOLECULAR WEIGHT: 220.24772
SMILES: C1=CC(=CN=C1)C2=NC(=CS2)CC(=O)O
Structure:
CAS RN: 847783-37-3
CAS Name: N-cyclopropyl-2-(1-piperazinyl)acetamide
OPENEYE Name: N-cyclopropyl-2-piperazin-1-yl-acetamide
IUPAC Name: N-cyclopropyl-2-piperazin-1-ylacetamide
SYSTEMATIC NAME: N-cyclopropyl-2-piperazin-1-yl-ethanamide
MOLECULAR FORMULA: C9H17N3O
MOLECULAR WEIGHT: 183.25078
SMILES: C1CC1NC(=O)CN2CCNCC2
Structure:
CAS RN: 56948-10-8
CAS Name: 2-bromo-4,5-dimethoxybenzenesulfonamide
OPENEYE Name: 2-bromo-4,5-dimethoxy-benzenesulfonamide
IUPAC Name: 2-bromo-4,5-dimethoxybenzenesulfonamide
SYSTEMATIC NAME: 2-bromanyl-4,5-dimethoxy-benzenesulfonamide
MOLECULAR FORMULA: C8H10BrNO4S
MOLECULAR WEIGHT: 296.1383
SMILES: COC1=CC(=C(C=C1OC)Br)S(=O)(=O)N
Structure:
CAS RN: 38752-40-8
CAS Name: 1-chloro-4-(2-isothiocyanatoethylthio)benzene
OPENEYE Name: 1-chloro-4-(2-isothiocyanatoethylsulfanyl)benzene
IUPAC Name: 1-chloro-4-(2-isothiocyanatoethylsulfanyl)benzene
SYSTEMATIC NAME: 1-chloranyl-4-(2-isothiocyanatoethylsulfanyl)benzene
MOLECULAR FORMULA: C9H8ClNS2
MOLECULAR WEIGHT: 229.74952
SMILES: C1=CC(=CC=C1SCCN=C=S)Cl
Structure:
CAS RN: 51802-78-9
CAS Name: 5-(chloromethyl)-3-(3-chlorophenyl)-1,2,4-oxadiazole
OPENEYE Name: 5-(chloromethyl)-3-(3-chlorophenyl)-1,2,4-oxadiazole
IUPAC Name: 5-(chloromethyl)-3-(3-chlorophenyl)-1,2,4-oxadiazole
SYSTEMATIC NAME: 5-(chloromethyl)-3-(3-chlorophenyl)-1,2,4-oxadiazole
MOLECULAR FORMULA: C9H6Cl2N2O
MOLECULAR WEIGHT: 229.06274
SMILES: C1=CC(=CC(=C1)Cl)C2=NOC(=N2)CCl
Structure:
CAS RN: 61689-98-3
CAS Name: 2-(1H-benzimidazol-2-yl)ethanethioamide
OPENEYE Name: 2-(1H-benzimidazol-2-yl)thioacetamide
IUPAC Name: 2-(1H-benzimidazol-2-yl)ethanethioamide
SYSTEMATIC NAME: 2-(1H-benzimidazol-2-yl)ethanethioamide
MOLECULAR FORMULA: C9H9N3S
MOLECULAR WEIGHT: 191.25286
SMILES: C1=CC=C2C(=C1)NC(=N2)CC(=S)N
Structure:
CAS RN: 199328-31-9
CAS Name: 2-oxo-1,3-dihydroindole-5-sulfonyl chloride
OPENEYE Name: 2-oxoindoline-5-sulfonyl chloride
IUPAC Name: 2-oxo-1,3-dihydroindole-5-sulfonyl chloride
SYSTEMATIC NAME: 2-oxidanylidene-1,3-dihydroindole-5-sulfonyl chloride
MOLECULAR FORMULA: C8H6ClNO3S
MOLECULAR WEIGHT: 231.65614
SMILES: C1C2=C(C=CC(=C2)S(=O)(=O)Cl)NC1=O
Structure:
CAS RN: 38752-37-3
CAS Name: (2-isothiocyanatoethylthio)benzene
OPENEYE Name: 2-isothiocyanatoethylsulfanylbenzene
IUPAC Name: 2-isothiocyanatoethylsulfanylbenzene
SYSTEMATIC NAME: 2-isothiocyanatoethylsulfanylbenzene
MOLECULAR FORMULA: C9H9NS2
MOLECULAR WEIGHT: 195.30446
SMILES: C1=CC=C(C=C1)SCCN=C=S
Structure:
CAS RN: 1665-41-4
CAS Name: 1-(5-phenyl-2-thiophenyl)ethanone
OPENEYE Name: 1-(5-phenyl-2-thienyl)ethanone
IUPAC Name: 1-(5-phenylthiophen-2-yl)ethanone
SYSTEMATIC NAME: 1-(5-phenylthiophen-2-yl)ethanone
MOLECULAR FORMULA: C12H10OS
MOLECULAR WEIGHT: 202.2722
SMILES: CC(=O)C1=CC=C(S1)C2=CC=CC=C2
Structure:
CAS RN: 160357-94-8
CAS Name: 1-(4-amino-1-piperidinyl)ethanone
OPENEYE Name: 1-(4-amino-1-piperidyl)ethanone
IUPAC Name: 1-(4-aminopiperidin-1-yl)ethanone
SYSTEMATIC NAME: 1-(4-azanylpiperidin-1-yl)ethanone
MOLECULAR FORMULA: C7H14N2O
MOLECULAR WEIGHT: 142.19886
SMILES: CC(=O)N1CCC(CC1)N
Structure:
CAS RN: 51072-64-1
CAS Name: 2-bromo-4,5-dimethoxybenzenesulfonyl chloride
OPENEYE Name: 2-bromo-4,5-dimethoxy-benzenesulfonyl chloride
IUPAC Name: 2-bromo-4,5-dimethoxybenzenesulfonyl chloride
SYSTEMATIC NAME: 2-bromanyl-4,5-dimethoxy-benzenesulfonyl chloride
MOLECULAR FORMULA: C8H8BrClO4S
MOLECULAR WEIGHT: 315.56872
SMILES: COC1=CC(=C(C=C1OC)Br)S(=O)(=O)Cl
Structure:
CAS RN: 37468-43-2
CAS Name: 1-butyl-5-(chloromethyl)tetrazole
OPENEYE Name: 1-butyl-5-(chloromethyl)tetrazole
IUPAC Name: 1-butyl-5-(chloromethyl)tetrazole
SYSTEMATIC NAME: 1-butyl-5-(chloromethyl)-1,2,3,4-tetrazole
MOLECULAR FORMULA: C6H11ClN4
MOLECULAR WEIGHT: 174.63134
SMILES: CCCCN1C(=NN=N1)CCl
Structure:
CAS RN: 67130-67-0
CAS Name: 6-amino-5-(2-chloro-1-oxoethyl)-1-ethylpyrimidine-2,4-dione
OPENEYE Name: 6-amino-5-(2-chloroacetyl)-1-ethyl-pyrimidine-2,4-dione
IUPAC Name: 6-amino-5-(2-chloroacetyl)-1-ethylpyrimidine-2,4-dione
SYSTEMATIC NAME: 6-azanyl-5-(2-chloranylethanoyl)-1-ethyl-pyrimidine-2,4-dione
MOLECULAR FORMULA: C8H10ClN3O3
MOLECULAR WEIGHT: 231.6363
SMILES: CCN1C(=C(C(=O)NC1=O)C(=O)CCl)N
Structure:
CAS RN: 28230-40-2
CAS Name: N-[bis(4-methoxyphenyl)methyl]-2-chloroacetamide
OPENEYE Name: N-[bis(4-methoxyphenyl)methyl]-2-chloro-acetamide
IUPAC Name: N-[bis(4-methoxyphenyl)methyl]-2-chloroacetamide
SYSTEMATIC NAME: N-[bis(4-methoxyphenyl)methyl]-2-chloranyl-ethanamide
MOLECULAR FORMULA: C17H18ClNO3
MOLECULAR WEIGHT: 319.78272
SMILES: COC1=CC=C(C=C1)C(C2=CC=C(C=C2)OC)NC(=O)CCl
Structure:
CAS RN: 23059-22-5
CAS Name: N-(3-methoxyphenyl)-3-oxo-3-(3-pyridinyl)propanamide
OPENEYE Name: N-(3-methoxyphenyl)-3-oxo-3-(3-pyridyl)propanamide
IUPAC Name: N-(3-methoxyphenyl)-3-oxo-3-pyridin-3-ylpropanamide
SYSTEMATIC NAME: N-(3-methoxyphenyl)-3-oxidanylidene-3-pyridin-3-yl-propanamide
MOLECULAR FORMULA: C15H14N2O3
MOLECULAR WEIGHT: 270.28326
SMILES: COC1=CC=CC(=C1)NC(=O)CC(=O)C2=CN=CC=C2
Structure:
CAS RN: 1148-53-4
CAS Name: N-(4-hydroxyphenyl)-N,4-dimethylbenzamide
OPENEYE Name: N-(4-hydroxyphenyl)-N,4-dimethyl-benzamide
IUPAC Name: N-(4-hydroxyphenyl)-N,4-dimethylbenzamide
SYSTEMATIC NAME: N-(4-hydroxyphenyl)-N,4-dimethyl-benzamide
MOLECULAR FORMULA: C15H15NO2
MOLECULAR WEIGHT: 241.2851
SMILES: CC1=CC=C(C=C1)C(=O)N(C)C2=CC=C(C=C2)O
Structure:
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