CAS RN: 83833-32-3
CAS Name: 2-(2,4-dichlorophenyl)-2-methyl-4-propyl-1,3-dioxolane
OPENEYE Name: 2-(2,4-dichlorophenyl)-2-methyl-4-propyl-1,3-dioxolane
IUPAC Name: 2-(2,4-dichlorophenyl)-2-methyl-4-propyl-1,3-dioxolane
SYSTEMATIC NAME: 2-(2,4-dichlorophenyl)-2-methyl-4-propyl-1,3-dioxolane
MOLECULAR FORMULA: C13H16Cl2O2
MOLECULAR WEIGHT: 275.17094
SMILES: CCCC1COC(O1)(C)C2=C(C=C(C=C2)Cl)Cl
Structure:
CAS RN: 13750-68-0
CAS Name: 4-methyl-2-thiazolecarboxaldehyde
OPENEYE Name: 4-methylthiazole-2-carbaldehyde
IUPAC Name: 4-methyl-1,3-thiazole-2-carbaldehyde
SYSTEMATIC NAME: 4-methyl-1,3-thiazole-2-carbaldehyde
MOLECULAR FORMULA: C5H5NOS
MOLECULAR WEIGHT: 127.1643
SMILES: CC1=CSC(=N1)C=O
Structure:
CAS RN: 6936-21-6
CAS Name: N-(7-chloro-3-nitro-9-oxo-2-fluorenyl)acetamide
OPENEYE Name: N-(7-chloro-3-nitro-9-oxo-fluoren-2-yl)acetamide
IUPAC Name: N-(7-chloro-3-nitro-9-oxofluoren-2-yl)acetamide
SYSTEMATIC NAME: N-(7-chloranyl-3-nitro-9-oxidanylidene-fluoren-2-yl)ethanamide
MOLECULAR FORMULA: C15H9ClN2O4
MOLECULAR WEIGHT: 316.69596
SMILES: CC(=O)NC1=C(C=C2C3=C(C=C(C=C3)Cl)C(=O)C2=C1)[N+](=O)[O-]
Structure:
CAS RN: 77523-96-7
CAS Name: 1-(1H-benzimidazol-2-ylmethyl)-3-(3-methylphenyl)thiourea
OPENEYE Name: 1-(1H-benzimidazol-2-ylmethyl)-3-(m-tolyl)thiourea
IUPAC Name: 1-(1H-benzimidazol-2-ylmethyl)-3-(3-methylphenyl)thiourea
SYSTEMATIC NAME: 1-(1H-benzimidazol-2-ylmethyl)-3-(3-methylphenyl)thiourea
MOLECULAR FORMULA: C16H16N4S
MOLECULAR WEIGHT: 296.39004
SMILES: CC1=CC(=CC=C1)NC(=S)NCC2=NC3=CC=CC=C3N2
Structure:
CAS RN: 31181-45-0
CAS Name: [(5-chloro-2-pyridinyl)methylideneamino]thiourea
OPENEYE Name: [(5-chloro-2-pyridyl)methyleneamino]thiourea
IUPAC Name: [(5-chloropyridin-2-yl)methylideneamino]thiourea
SYSTEMATIC NAME: 1-[(5-chloranylpyridin-2-yl)methylideneamino]thiourea
MOLECULAR FORMULA: C7H7ClN4S
MOLECULAR WEIGHT: 214.67528
SMILES: C1=CC(=NC=C1Cl)C=NNC(=S)N
Structure:
CAS RN: 56236-73-8
CAS Name: 4-(propylsulfamoyl)benzenecarbothioamide
OPENEYE Name: 4-(propylsulfamoyl)benzenecarbothioamide
IUPAC Name: 4-(propylsulfamoyl)benzenecarbothioamide
SYSTEMATIC NAME: 4-(propylsulfamoyl)benzenecarbothioamide
MOLECULAR FORMULA: C10H14N2O2S2
MOLECULAR WEIGHT: 258.36036
SMILES: CCCNS(=O)(=O)C1=CC=C(C=C1)C(=S)N
Structure:
CAS RN: 2239-64-7
CAS Name: 9-[4-hydroxy-5-(hydroxymethyl)-2-oxolanyl]-3H-purine-6-thione
OPENEYE Name: 9-[4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-3H-purine-6-thione
IUPAC Name: 9-[4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-3H-purine-6-thione
SYSTEMATIC NAME: 9-[5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]-3H-purine-6-thione
MOLECULAR FORMULA: C10H12N4O3S
MOLECULAR WEIGHT: 268.29228
SMILES: C1C(C(OC1N2C=NC3=C2NC=NC3=S)CO)O
Structure:
CAS RN: 2946-46-5
CAS Name: 9-[4-hydroxy-5-(hydroxymethyl)-2-oxolanyl]-3H-purine-6-thione
OPENEYE Name: 9-[4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-3H-purine-6-thione
IUPAC Name: 9-[4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-3H-purine-6-thione
SYSTEMATIC NAME: 9-[5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]-3H-purine-6-thione
MOLECULAR FORMULA: C10H12N4O3S
MOLECULAR WEIGHT: 268.29228
SMILES: C1C(C(OC1N2C=NC3=C2NC=NC3=S)CO)O
Structure:
CAS RN: 91011-20-0
CAS Name: 6-(3-methylbutylthio)-7H-purin-2-amine
OPENEYE Name: 6-isopentylsulfanyl-7H-purin-2-amine
IUPAC Name: 6-(3-methylbutylsulfanyl)-7H-purin-2-amine
SYSTEMATIC NAME: 6-(3-methylbutylsulfanyl)-7H-purin-2-amine
MOLECULAR FORMULA: C10H15N5S
MOLECULAR WEIGHT: 237.3246
SMILES: CC(C)CCSC1=NC(=NC2=C1NC=N2)N
Structure:
CAS RN: 6492-95-1
CAS Name: 1,3-dimethyl-8-(octan-2-ylthio)-6-sulfanylidene-7H-purin-2-one
OPENEYE Name: 1,3-dimethyl-8-(1-methylheptylsulfanyl)-6-thioxo-7H-purin-2-one
IUPAC Name: 1,3-dimethyl-8-octan-2-ylsulfanyl-6-sulfanylidene-7H-purin-2-one
SYSTEMATIC NAME: 1,3-dimethyl-8-octan-2-ylsulfanyl-6-sulfanylidene-7H-purin-2-one
MOLECULAR FORMULA: C15H24N4OS2
MOLECULAR WEIGHT: 340.50726
SMILES: CCCCCCC(C)SC1=NC2=C(N1)C(=S)N(C(=O)N2C)C
Structure:
CAS RN: 30148-21-1
CAS Name: 1-methyl-2-imidazolecarboxylic acid ethyl ester
OPENEYE Name: ethyl 1-methylimidazole-2-carboxylate
IUPAC Name: ethyl 1-methylimidazole-2-carboxylate
SYSTEMATIC NAME: ethyl 1-methylimidazole-2-carboxylate
MOLECULAR FORMULA: C7H10N2O2
MOLECULAR WEIGHT: 154.1665
SMILES: CCOC(=O)C1=NC=CN1C
Structure:
CAS RN: 6492-98-4
CAS Name: 8-(2-ethylhexylthio)-1,3-dimethyl-6-sulfanylidene-7H-purin-2-one
OPENEYE Name: 8-(2-ethylhexylsulfanyl)-1,3-dimethyl-6-thioxo-7H-purin-2-one
IUPAC Name: 8-(2-ethylhexylsulfanyl)-1,3-dimethyl-6-sulfanylidene-7H-purin-2-one
SYSTEMATIC NAME: 8-(2-ethylhexylsulfanyl)-1,3-dimethyl-6-sulfanylidene-7H-purin-2-one
MOLECULAR FORMULA: C15H24N4OS2
MOLECULAR WEIGHT: 340.50726
SMILES: CCCCC(CC)CSC1=NC2=C(N1)C(=S)N(C(=O)N2C)C
Structure:
CAS RN: 23552-71-8
CAS Name: 4-nitro-N-[4-(pyridin-4-ylamino)phenyl]benzamide
OPENEYE Name: 4-nitro-N-[4-(4-pyridylamino)phenyl]benzamide
IUPAC Name: 4-nitro-N-[4-(pyridin-4-ylamino)phenyl]benzamide
SYSTEMATIC NAME: 4-nitro-N-[4-(pyridin-4-ylamino)phenyl]benzamide
MOLECULAR FORMULA: C18H14N4O3
MOLECULAR WEIGHT: 334.32876
SMILES: C1=CC(=CC=C1C(=O)NC2=CC=C(C=C2)NC3=CC=NC=C3)[N+](=O)[O-]
Structure:
CAS RN: 18667-39-5
CAS Name: 1-methyl-3-[11-[[methylamino(sulfanylidene)methyl]hydrazinylidene]dodecan-2-ylideneamino]thiourea
OPENEYE Name: 1-methyl-3-[[1-methyl-10-(methylcarbamothioylhydrazono)undecylidene]amino]thiourea
IUPAC Name: 1-methyl-3-[11-(methylcarbamothioylhydrazinylidene)dodecan-2-ylideneamino]thiourea
SYSTEMATIC NAME: 1-methyl-3-[11-(methylcarbamothioylhydrazinylidene)dodecan-2-ylideneamino]thiourea
MOLECULAR FORMULA: C16H32N6S2
MOLECULAR WEIGHT: 372.59548
SMILES: CC(=NNC(=S)NC)CCCCCCCCC(=NNC(=S)NC)C
Structure:
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