CAS RN: 6099-57-6
CAS Name: sodium 4-hydroxy-1-naphthalenesulfonate
OPENEYE Name: sodium 4-hydroxynaphthalene-1-sulfonate
IUPAC Name: sodium 4-hydroxynaphthalene-1-sulfonate
SYSTEMATIC NAME: sodium 4-oxidanylnaphthalene-1-sulfonate
MOLECULAR FORMULA: C10H7NaO4S
MOLECULAR WEIGHT: 246.21495
SMILES: C1=CC=C2C(=C1)C(=CC=C2S(=O)(=O)[O-])O.[Na+]
Structure:
CAS RN: 787591-39-3
CAS Name: 4-[2-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy]ethyl]morpholine
OPENEYE Name: 4-[2-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy]ethyl]morpholine
IUPAC Name: 4-[2-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy]ethyl]morpholine
SYSTEMATIC NAME: 4-[2-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy]ethyl]morpholine
MOLECULAR FORMULA: C18H28BNO4
MOLECULAR WEIGHT: 333.23022
SMILES: B1(OC(C(O1)(C)C)(C)C)C2=CC=C(C=C2)OCCN3CCOCC3
Structure:
CAS RN: 73101-09-4
CAS Name: 2-amino-2-(2,3-dihydro-1,4-benzodioxin-6-yl)acetic acid
OPENEYE Name: 2-amino-2-(2,3-dihydro-1,4-benzodioxin-6-yl)acetic acid
IUPAC Name: 2-amino-2-(2,3-dihydro-1,4-benzodioxin-6-yl)acetic acid
SYSTEMATIC NAME: 2-azanyl-2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanoic acid
MOLECULAR FORMULA: C10H11NO4
MOLECULAR WEIGHT: 209.19864
SMILES: C1COC2=C(O1)C=CC(=C2)C(C(=O)O)N
Structure:
CAS RN: 29840-73-1
CAS Name: 2-bromo-4-pyridinecarboxamide
OPENEYE Name: 2-bromopyridine-4-carboxamide
IUPAC Name: 2-bromopyridine-4-carboxamide
SYSTEMATIC NAME: 2-bromanylpyridine-4-carboxamide
MOLECULAR FORMULA: C6H5BrN2O
MOLECULAR WEIGHT: 201.0207
SMILES: C1=CN=C(C=C1C(=O)N)Br
Structure:
CAS RN: 69729-06-2
CAS Name: 2-[[2-[[2-[[2-[(2-amino-1-oxo-3-phenylpropyl)amino]-4-methyl-1-oxopentyl]amino]-4-carboxy-1-oxobutyl]amino]-4-carboxy-1-oxobutyl]amino]-4-methylpentanoic acid
OPENEYE Name: 2-[[2-[[2-[[2-[(2-amino-3-phenyl-propanoyl)amino]-4-methyl-pentanoyl]amino]-4-carboxy-butanoyl]amino]-4-carboxy-butanoyl]amino]-4-methyl-pentanoic acid
IUPAC Name: 2-[[2-[[2-[[2-[(2-amino-3-phenylpropanoyl)amino]-4-methylpentanoyl]amino]-4-carboxybutanoyl]amino]-4-carboxybutanoyl]amino]-4-methylpentanoic acid
SYSTEMATIC NAME: 2-[[2-[[2-[[2-[(2-azanyl-3-phenyl-propanoyl)amino]-4-methyl-pentanoyl]amino]-5-oxidanyl-5-oxidanylidene-pentanoyl]amino]-5-oxidanyl-5-oxidanylidene-pentanoyl]amino]-4-methyl-pentanoic acid
MOLECULAR FORMULA: C31H47N5O10
MOLECULAR WEIGHT: 649.73238
SMILES: CC(C)CC(C(=O)NC(CCC(=O)O)C(=O)NC(CCC(=O)O)C(=O)NC(CC(C)C)C(=O)O)NC(=O)C(CC1=CC=CC=C1)N
Structure:
CAS RN: 13269-77-7
CAS Name: 2-(diethoxymethyl)oxirane
OPENEYE Name: 2-(diethoxymethyl)oxirane
IUPAC Name: 2-(diethoxymethyl)oxirane
SYSTEMATIC NAME: 2-(diethoxymethyl)oxirane
MOLECULAR FORMULA: C7H14O3
MOLECULAR WEIGHT: 146.18426
SMILES: CCOC(C1CO1)OCC
Structure:
CAS RN: 411238-88-5
CAS Name: 3-(hydrazinecarbonyl)-1-pyrrolidinecarboxylic acid tert-butyl ester
OPENEYE Name: tert-butyl 3-(hydrazinecarbonyl)pyrrolidine-1-carboxylate
IUPAC Name: tert-butyl 3-(hydrazinecarbonyl)pyrrolidine-1-carboxylate
SYSTEMATIC NAME: tert-butyl 3-(aminocarbamoyl)pyrrolidine-1-carboxylate
MOLECULAR FORMULA: C10H19N3O3
MOLECULAR WEIGHT: 229.27616
SMILES: CC(C)(C)OC(=O)N1CCC(C1)C(=O)NN
Structure:
CAS RN: 90642-34-5
CAS Name: 1-methyl-1-nitroso-3-[2-(6-sulfanylidene-3H-purin-9-yl)ethyl]urea
OPENEYE Name: 1-methyl-1-nitroso-3-[2-(6-thioxo-3H-purin-9-yl)ethyl]urea
IUPAC Name: 1-methyl-1-nitroso-3-[2-(6-sulfanylidene-3H-purin-9-yl)ethyl]urea
SYSTEMATIC NAME: 1-methyl-1-nitroso-3-[2-(6-sulfanylidene-3H-purin-9-yl)ethyl]urea
MOLECULAR FORMULA: C9H11N7O2S
MOLECULAR WEIGHT: 281.29434
SMILES: CN(C(=O)NCCN1C=NC2=C1NC=NC2=S)N=O
Structure:
CAS RN: 14464-31-4
CAS Name: hexadecanoic acid (2,5-dioxo-1-pyrrolidinyl) ester
OPENEYE Name: (2,5-dioxopyrrolidin-1-yl) hexadecanoate
IUPAC Name: (2,5-dioxopyrrolidin-1-yl) hexadecanoate
SYSTEMATIC NAME: [2,5-bis(oxidanylidene)pyrrolidin-1-yl] hexadecanoate
MOLECULAR FORMULA: C20H35NO4
MOLECULAR WEIGHT: 353.4962
SMILES: CCCCCCCCCCCCCCCC(=O)ON1C(=O)CCC1=O
Structure:
CAS RN: 276872-86-7
CAS Name: 3-formyl-1-pyrrolidinecarboxylic acid (phenylmethyl) ester
OPENEYE Name: benzyl 3-formylpyrrolidine-1-carboxylate
IUPAC Name: benzyl 3-formylpyrrolidine-1-carboxylate
SYSTEMATIC NAME: (phenylmethyl) 3-methanoylpyrrolidine-1-carboxylate
MOLECULAR FORMULA: C13H15NO3
MOLECULAR WEIGHT: 233.2631
SMILES: C1CN(CC1C=O)C(=O)OCC2=CC=CC=C2
Structure:
CAS RN: 26157-85-7
CAS Name: 3-bromobenzenecarboximidamide
OPENEYE Name: 3-bromobenzamidine
IUPAC Name: 3-bromobenzenecarboximidamide
SYSTEMATIC NAME: 3-bromanylbenzenecarboximidamide
MOLECULAR FORMULA: C7H7BrN2
MOLECULAR WEIGHT: 199.04788
SMILES: C1=CC(=CC(=C1)Br)C(=N)N
Structure:
CAS RN: 5864-00-6
CAS Name: N-(3-chloro-4-methylphenyl)-6-methyl-2-oxo-4-thiophen-2-yl-3,4-dihydro-1H-pyrimidine-5-carboxamide
OPENEYE Name: N-(3-chloro-4-methyl-phenyl)-6-methyl-2-oxo-4-(2-thienyl)-3,4-dihydro-1H-pyrimidine-5-carboxamide
IUPAC Name: N-(3-chloro-4-methylphenyl)-6-methyl-2-oxo-4-thiophen-2-yl-3,4-dihydro-1H-pyrimidine-5-carboxamide
SYSTEMATIC NAME: N-(3-chloranyl-4-methyl-phenyl)-6-methyl-2-oxidanylidene-4-thiophen-2-yl-3,4-dihydro-1H-pyrimidine-5-carboxamide
MOLECULAR FORMULA: C17H16ClN3O2S
MOLECULAR WEIGHT: 361.84584
SMILES: CC1=C(C=C(C=C1)NC(=O)C2=C(NC(=O)NC2C3=CC=CS3)C)Cl
Structure:
CAS RN: 6300-87-4
CAS Name: 1-(4-nitrophenyl)-3-[(5-nitro-2-pyridinyl)amino]urea
OPENEYE Name: 1-(4-nitrophenyl)-3-[(5-nitro-2-pyridyl)amino]urea
IUPAC Name: 1-(4-nitrophenyl)-3-[(5-nitropyridin-2-yl)amino]urea
SYSTEMATIC NAME: 1-(4-nitrophenyl)-3-[(5-nitropyridin-2-yl)amino]urea
MOLECULAR FORMULA: C12H10N6O5
MOLECULAR WEIGHT: 318.245
SMILES: C1=CC(=CC=C1NC(=O)NNC2=NC=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]
Structure:
CAS RN: 6319-87-5
CAS Name: 2-methyl-3-phenyl-4-quinolinecarboxylate
OPENEYE Name: 2-methyl-3-phenyl-quinoline-4-carboxylate
IUPAC Name: 2-methyl-3-phenylquinoline-4-carboxylate
SYSTEMATIC NAME: 2-methyl-3-phenyl-quinoline-4-carboxylate
MOLECULAR FORMULA: C17H12NO2-
MOLECULAR WEIGHT: 262.28268
SMILES: CC1=NC2=CC=CC=C2C(=C1C3=CC=CC=C3)C(=O)[O-]
Structure:
CAS RN: 66645-98-5
CAS Name: N-[sulfanylidene-(3-thiophenylamino)methyl]carbamic acid ethyl ester
OPENEYE Name: ethyl N-(3-thienylcarbamothioyl)carbamate
IUPAC Name: ethyl N-(thiophen-3-ylcarbamothioyl)carbamate
SYSTEMATIC NAME: ethyl N-(thiophen-3-ylcarbamothioyl)carbamate
MOLECULAR FORMULA: C8H10N2O2S2
MOLECULAR WEIGHT: 230.3072
SMILES: CCOC(=O)NC(=S)NC1=CSC=C1
Structure:
CAS RN: 42238-98-2
CAS Name: 1-(phenylmethyl)-[1,2,4]triazolo[4,3-a]pyridin-4-ium-3-olate
OPENEYE Name: 1-benzyl-[1,2,4]triazolo[4,3-a]pyridin-4-ium-3-olate
IUPAC Name: 1-benzyl-[1,2,4]triazolo[4,3-a]pyridin-4-ium-3-olate
SYSTEMATIC NAME: 1-(phenylmethyl)-[1,2,4]triazolo[4,3-a]pyridin-4-ium-3-olate
MOLECULAR FORMULA: C13H11N3O
MOLECULAR WEIGHT: 225.24594
SMILES: C1=CC=C(C=C1)CN2C3=CC=CC=[N+]3C(=N2)[O-]
Structure:
CAS RN: 59855-11-7
CAS Name: [amino-(4-carbamoylphenyl)methylidene]ammonium
OPENEYE Name: [amino-(4-carbamoylphenyl)methylene]ammonium
IUPAC Name: [amino-(4-carbamoylphenyl)methylidene]azanium
SYSTEMATIC NAME: [(4-aminocarbonylphenyl)-azanyl-methylidene]azanium
MOLECULAR FORMULA: C8H10N3O+
MOLECULAR WEIGHT: 164.1845
SMILES: C1=CC(=CC=C1C(=[NH2+])N)C(=O)N
Structure:
CAS RN: 7253-36-3
CAS Name: 1-(2-ethylhexylideneamino)-3-octadecylthiourea
OPENEYE Name: 1-(2-ethylhexylideneamino)-3-octadecyl-thiourea
IUPAC Name: 1-(2-ethylhexylideneamino)-3-octadecylthiourea
SYSTEMATIC NAME: 1-(2-ethylhexylideneamino)-3-octadecyl-thiourea
MOLECULAR FORMULA: C27H55N3S
MOLECULAR WEIGHT: 453.8107
SMILES: CCCCCCCCCCCCCCCCCCNC(=S)NN=CC(CC)CCCC
Structure:
CAS RN: 27894-32-2
CAS Name: acetic acid [4,5-diacetyloxy-2-methyl-6-(6-sulfanylidene-3H-purin-9-yl)-3-oxanyl] ester
OPENEYE Name: [4,5-diacetoxy-2-methyl-6-(6-thioxo-3H-purin-9-yl)tetrahydropyran-3-yl] acetate
IUPAC Name: [4,5-diacetyloxy-2-methyl-6-(6-sulfanylidene-3H-purin-9-yl)oxan-3-yl] acetate
SYSTEMATIC NAME: [4,5-diacetyloxy-2-methyl-6-(6-sulfanylidene-3H-purin-9-yl)oxan-3-yl] ethanoate
MOLECULAR FORMULA: C17H20N4O7S
MOLECULAR WEIGHT: 424.4283
SMILES: CC1C(C(C(C(O1)N2C=NC3=C2NC=NC3=S)OC(=O)C)OC(=O)C)OC(=O)C
Structure:
CAS RN: 93320-98-0
CAS Name: 6-[(2-methyl-1-naphthalenyl)methylthio]-7H-purine
OPENEYE Name: 6-[(2-methyl-1-naphthyl)methylsulfanyl]-7H-purine
IUPAC Name: 6-[(2-methylnaphthalen-1-yl)methylsulfanyl]-7H-purine
SYSTEMATIC NAME: 6-[(2-methylnaphthalen-1-yl)methylsulfanyl]-7H-purine
MOLECULAR FORMULA: C17H14N4S
MOLECULAR WEIGHT: 306.38486
SMILES: CC1=C(C2=CC=CC=C2C=C1)CSC3=NC=NC4=C3NC=N4
Structure:
CAS RN: 65709-33-3
CAS Name: 2-(4-fluorophenyl)piperazine
OPENEYE Name: 2-(4-fluorophenyl)piperazine
IUPAC Name: 2-(4-fluorophenyl)piperazine
SYSTEMATIC NAME: 2-(4-fluorophenyl)piperazine
MOLECULAR FORMULA: C10H13FN2
MOLECULAR WEIGHT: 180.222023
SMILES: C1CNC(CN1)C2=CC=C(C=C2)F
Structure:
No comments:
Post a Comment