CAS RN: 143416-74-4
CAS Name: 2-chloro-N-(5-methyl-2-pyridinyl)acetamide
OPENEYE Name: 2-chloro-N-(5-methyl-2-pyridyl)acetamide
IUPAC Name: 2-chloro-N-(5-methylpyridin-2-yl)acetamide
SYSTEMATIC NAME: 2-chloranyl-N-(5-methylpyridin-2-yl)ethanamide
MOLECULAR FORMULA: C8H9ClN2O
MOLECULAR WEIGHT: 184.62286
SMILES: CC1=CN=C(C=C1)NC(=O)CCl
Structure:
CAS RN: 66753-07-9
CAS Name: 2-(tert-butylamino)-6-(ethylamino)-1H-1,3,5-triazin-4-one
OPENEYE Name: 2-(tert-butylamino)-6-(ethylamino)-1H-1,3,5-triazin-4-one
IUPAC Name: 2-(tert-butylamino)-6-(ethylamino)-1H-1,3,5-triazin-4-one
SYSTEMATIC NAME: 2-(tert-butylamino)-6-(ethylamino)-1H-1,3,5-triazin-4-one
MOLECULAR FORMULA: C9H17N5O
MOLECULAR WEIGHT: 211.26418
SMILES: CCNC1=NC(=O)N=C(N1)NC(C)(C)C
Structure:
CAS RN: 73873-85-5
CAS Name: 5-[1-(3-methoxyphenyl)ethylidene]-2-sulfanylidene-4-thiazolidinone
OPENEYE Name: 5-[1-(3-methoxyphenyl)ethylidene]-2-thioxo-thiazolidin-4-one
IUPAC Name: 5-[1-(3-methoxyphenyl)ethylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
SYSTEMATIC NAME: 5-[1-(3-methoxyphenyl)ethylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
MOLECULAR FORMULA: C12H11NO2S2
MOLECULAR WEIGHT: 265.35124
SMILES: CC(=C1C(=O)NC(=S)S1)C2=CC(=CC=C2)OC
Structure:
CAS RN: 212632-34-3
CAS Name: 2-[[5-(dibutylamino)-2-thiophenyl]methylidene]indene-1,3-dione
OPENEYE Name: 2-[[5-(dibutylamino)-2-thienyl]methylene]indane-1,3-dione
IUPAC Name: 2-[[5-(dibutylamino)thiophen-2-yl]methylidene]indene-1,3-dione
SYSTEMATIC NAME: 2-[[5-(dibutylamino)thiophen-2-yl]methylidene]indene-1,3-dione
MOLECULAR FORMULA: C22H25NO2S
MOLECULAR WEIGHT: 367.5044
SMILES: CCCCN(CCCC)C1=CC=C(S1)C=C2C(=O)C3=CC=CC=C3C2=O
Structure:
CAS RN: 2481-89-2
CAS Name: 2-diazonio-5-[[4-[4-[(6-diazonio-5-oxido-1-naphthalenyl)sulfonylamino]phenyl]phenyl]sulfamoyl]-1-naphthalenolate
OPENEYE Name: 2-diazonio-5-[[4-[4-[(6-diazonio-5-oxido-1-naphthyl)sulfonylamino]phenyl]phenyl]sulfamoyl]naphthalen-1-olate
IUPAC Name: 2-diazonio-5-[[4-[4-[(6-diazonio-5-oxidonaphthalen-1-yl)sulfonylamino]phenyl]phenyl]sulfamoyl]naphthalen-1-olate
SYSTEMATIC NAME: 2-diazonio-5-[[4-[4-[(6-diazonio-5-oxidanidyl-naphthalen-1-yl)sulfonylamino]phenyl]phenyl]sulfamoyl]naphthalen-1-olate
MOLECULAR FORMULA: C32H20N6O6S2
MOLECULAR WEIGHT: 648.6678
SMILES: C1=CC2=C(C=CC(=C2[O-])[N+]#N)C(=C1)S(=O)(=O)NC3=CC=C(C=C3)C4=CC=C(C=C4)NS(=O)(=O)C5=CC=CC6=C5C=CC(=C6[O-])[N+]#N
Structure:
CAS RN: 25565-69-9
CAS Name: 4-(3-chloro-4-methylphenyl)-1-piperazinecarbothioamide
OPENEYE Name: 4-(3-chloro-4-methyl-phenyl)piperazine-1-carbothioamide
IUPAC Name: 4-(3-chloro-4-methylphenyl)piperazine-1-carbothioamide
SYSTEMATIC NAME: 4-(3-chloranyl-4-methyl-phenyl)piperazine-1-carbothioamide
MOLECULAR FORMULA: C12H16ClN3S
MOLECULAR WEIGHT: 269.79354
SMILES: CC1=C(C=C(C=C1)N2CCN(CC2)C(=S)N)Cl
Structure:
CAS RN: 14937-64-5
CAS Name: 2-amino-9-phenyl-3H-purine-6-thione
OPENEYE Name: 2-amino-9-phenyl-3H-purine-6-thione
IUPAC Name: 2-amino-9-phenyl-3H-purine-6-thione
SYSTEMATIC NAME: 2-azanyl-9-phenyl-3H-purine-6-thione
MOLECULAR FORMULA: C11H9N5S
MOLECULAR WEIGHT: 243.28766
SMILES: C1=CC=C(C=C1)N2C=NC3=C2NC(=NC3=S)N
Structure:
CAS RN: 35803-35-1
CAS Name: 2-[2-[bis(carboxymethyl)amino]ethyl-(carboxymethyl)amino]acetic acid; cadmium(2+)
OPENEYE Name: 2-[2-[bis(carboxymethyl)amino]ethyl-(carboxymethyl)amino]acetic acid; cadmium(2+)
IUPAC Name: 2-[2-[bis(carboxymethyl)amino]ethyl-(carboxymethyl)amino]acetic acid; cadmium(2+)
SYSTEMATIC NAME: 2-[2-[bis(2-hydroxy-2-oxoethyl)amino]ethyl-(2-hydroxy-2-oxoethyl)amino]ethanoic acid; cadmium(2+)
MOLECULAR FORMULA: C10H16CdN2O8+2
MOLECULAR WEIGHT: 404.65364
SMILES: C(CN(CC(=O)O)CC(=O)O)N(CC(=O)O)CC(=O)O.[Cd+2]
Structure:
CAS RN: 39888-51-2
CAS Name: 4-azepanol
OPENEYE Name: azepan-4-ol
IUPAC Name: azepan-4-ol
SYSTEMATIC NAME: azepan-4-ol
MOLECULAR FORMULA: C6H13NO
MOLECULAR WEIGHT: 115.17352
SMILES: C1CC(CCNC1)O
Structure:
CAS RN: 26075-94-5
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C21H22N2O5S2
MOLECULAR WEIGHT: 446.53978
SMILES: C1C[N+]2(CC3=CCOC4CC(=O)N5C6C4C3CC2C61C7=CC=CC=C75)SS(=O)(=O)[O-]
Structure:
CAS RN: 34550-61-3
CAS Name: 1,2-dihydrotriazolo[4,5-c]pyridine-4-thione
OPENEYE Name: 1,2-dihydrotriazolo[4,5-c]pyridine-4-thione
IUPAC Name: 1,2-dihydrotriazolo[4,5-c]pyridine-4-thione
SYSTEMATIC NAME: 1,2-dihydro-[1,2,3]triazolo[4,5-c]pyridine-4-thione
MOLECULAR FORMULA: C5H4N4S
MOLECULAR WEIGHT: 152.17706
SMILES: C1=C2C(=NNN2)C(=S)N=C1
Structure:
CAS RN: 19594-25-3
CAS Name: N-methylcarbamodithioic acid (phenylmethyl) ester
OPENEYE Name: benzyl N-methylcarbamodithioate
IUPAC Name: benzyl N-methylcarbamodithioate
SYSTEMATIC NAME: (phenylmethyl) N-methylcarbamodithioate
MOLECULAR FORMULA: C9H11NS2
MOLECULAR WEIGHT: 197.32034
SMILES: CNC(=S)SCC1=CC=CC=C1
Structure:
CAS RN: 10486-08-5
CAS Name: sodium 4-methylbenzenethiolate
OPENEYE Name: sodium 4-methylbenzenethiolate
IUPAC Name: sodium 4-methylbenzenethiolate
SYSTEMATIC NAME: sodium 4-methylbenzenethiolate
MOLECULAR FORMULA: C7H7NaS
MOLECULAR WEIGHT: 146.18525
SMILES: CC1=CC=C(C=C1)[S-].[Na+]
Structure:
CAS RN: 73286-70-1
CAS Name: 2,5-dihydropyrrole-1-carboxylic acid tert-butyl ester
OPENEYE Name: tert-butyl 2,5-dihydropyrrole-1-carboxylate
IUPAC Name: tert-butyl 2,5-dihydropyrrole-1-carboxylate
SYSTEMATIC NAME: tert-butyl 2,5-dihydropyrrole-1-carboxylate
MOLECULAR FORMULA: C9H15NO2
MOLECULAR WEIGHT: 169.2209
SMILES: CC(C)(C)OC(=O)N1CC=CC1
Structure:
CAS RN: 75181-07-6
CAS Name: 1,2,3,4,5-pentamethylcyclopenta-1,3-diene; trichlorozirconium
OPENEYE Name: 1,2,3,4,5-pentamethylcyclopenta-1,3-diene; trichlorozirconium
IUPAC Name: 1,2,3,4,5-pentamethylcyclopenta-1,3-diene; trichlorozirconium
SYSTEMATIC NAME: 1,2,3,4,5-pentamethylcyclopenta-1,3-diene; tris(chloranyl)zirconium
MOLECULAR FORMULA: C10H15Cl3Zr-
MOLECULAR WEIGHT: 332.8091
SMILES: C[C-]1C(=C(C(=C1C)C)C)C.Cl[Zr](Cl)Cl
Structure:
CAS RN: 57444-62-9
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C37H40O9
MOLECULAR WEIGHT: 628.7081
SMILES: CC1CC2(C3C4C1(C5C=C(C(=O)C5(CC(=C4)COC(=O)CC6=CC(=C(C=C6)O)OC)O)C)OC(O3)(O2)CC7=CC=CC=C7)C(=C)C
Structure:
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