CAS RN: 113518-53-9
CAS Name: N-(4-nitrophenyl)-2-[(4-phenyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)thio]acetamide
OPENEYE Name: N-(4-nitrophenyl)-2-[[4-phenyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide
IUPAC Name: N-(4-nitrophenyl)-2-[(4-phenyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide
SYSTEMATIC NAME: N-(4-nitrophenyl)-2-[(4-phenyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]ethanamide
MOLECULAR FORMULA: C21H16N6O3S
MOLECULAR WEIGHT: 432.45514
SMILES: C1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NC3=CC=C(C=C3)[N+](=O)[O-])C4=CC=NC=C4
Structure:
CAS RN: 4249-79-0
CAS Name: 2-[6-[[(4-chlorophenyl)thio]methyl]-4-oxo-1H-pyrimidin-2-yl]-1-(4-fluorophenyl)guanidine
OPENEYE Name: 2-[6-[(4-chlorophenyl)sulfanylmethyl]-4-oxo-1H-pyrimidin-2-yl]-1-(4-fluorophenyl)guanidine
IUPAC Name: 2-[6-[(4-chlorophenyl)sulfanylmethyl]-4-oxo-1H-pyrimidin-2-yl]-1-(4-fluorophenyl)guanidine
SYSTEMATIC NAME: 2-[6-[(4-chlorophenyl)sulfanylmethyl]-4-oxidanylidene-1H-pyrimidin-2-yl]-1-(4-fluorophenyl)guanidine
MOLECULAR FORMULA: C18H15ClFN5OS
MOLECULAR WEIGHT: 403.861003
SMILES: C1=CC(=CC=C1NC(=NC2=NC(=O)C=C(N2)CSC3=CC=C(C=C3)Cl)N)F
Structure:
CAS RN: 4474-29-7
CAS Name: 2-(2-butan-2-ylphenoxy)-N-(1-naphthalenyl)acetamide
OPENEYE Name: N-(1-naphthyl)-2-(2-sec-butylphenoxy)acetamide
IUPAC Name: 2-(2-butan-2-ylphenoxy)-N-naphthalen-1-ylacetamide
SYSTEMATIC NAME: 2-(2-butan-2-ylphenoxy)-N-naphthalen-1-yl-ethanamide
MOLECULAR FORMULA: C22H23NO2
MOLECULAR WEIGHT: 333.42352
SMILES: CCC(C)C1=CC=CC=C1OCC(=O)NC2=CC=CC3=CC=CC=C32
Structure:
CAS RN: 5414-65-3
CAS Name: 2-[(4-bromophenyl)methylamino]ethanol hydrochloride
OPENEYE Name: 2-[(4-bromophenyl)methylamino]ethanol hydrochloride
IUPAC Name: 2-[(4-bromophenyl)methylamino]ethanol hydrochloride
SYSTEMATIC NAME: 2-[(4-bromophenyl)methylamino]ethanol hydrochloride
MOLECULAR FORMULA: C9H13BrClNO
MOLECULAR WEIGHT: 266.56262
SMILES: C1=CC(=CC=C1CNCCO)Br.Cl
Structure:
CAS RN: 4472-62-2
CAS Name: 2-(2-butan-2-ylphenoxy)-N-(3-cyanophenyl)acetamide
OPENEYE Name: N-(3-cyanophenyl)-2-(2-sec-butylphenoxy)acetamide
IUPAC Name: 2-(2-butan-2-ylphenoxy)-N-(3-cyanophenyl)acetamide
SYSTEMATIC NAME: 2-(2-butan-2-ylphenoxy)-N-(3-cyanophenyl)ethanamide
MOLECULAR FORMULA: C19H20N2O2
MOLECULAR WEIGHT: 308.3743
SMILES: CCC(C)C1=CC=CC=C1OCC(=O)NC2=CC=CC(=C2)C#N
Structure:
CAS RN: 4470-98-8
CAS Name: N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-ethoxybenzamide
OPENEYE Name: N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-3-ethoxy-benzamide
IUPAC Name: N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-ethoxybenzamide
SYSTEMATIC NAME: N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-ethoxy-benzamide
MOLECULAR FORMULA: C22H26N2O2S
MOLECULAR WEIGHT: 382.51904
SMILES: CCOC1=CC=CC(=C1)C(=O)NC2=C(C3=C(S2)CC(CC3)C(C)(C)C)C#N
Structure:
CAS RN: 4470-37-5
CAS Name: N-(5-but-2-en-2-yl-1,3,4-thiadiazol-2-yl)-2-phenylacetamide
OPENEYE Name: N-[5-(1-methylprop-1-enyl)-1,3,4-thiadiazol-2-yl]-2-phenyl-acetamide
IUPAC Name: N-(5-but-2-en-2-yl-1,3,4-thiadiazol-2-yl)-2-phenylacetamide
SYSTEMATIC NAME: N-(5-but-2-en-2-yl-1,3,4-thiadiazol-2-yl)-2-phenyl-ethanamide
MOLECULAR FORMULA: C14H15N3OS
MOLECULAR WEIGHT: 273.3534
SMILES: CC=C(C)C1=NN=C(S1)NC(=O)CC2=CC=CC=C2
Structure:
CAS RN: 77871-88-6
CAS Name: 2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylic acid methyl ester hydrochloride
OPENEYE Name: methyl 2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate hydrochloride
IUPAC Name: methyl 2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate hydrochloride
SYSTEMATIC NAME: methyl 2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate hydrochloride
MOLECULAR FORMULA: C13H15ClN2O2
MOLECULAR WEIGHT: 266.7234
SMILES: COC(=O)C1CC2=C(CN1)NC3=CC=CC=C23.Cl
Structure:
CAS RN: 669750-24-7
CAS Name: 4-methyl-3-(1-phenoxyethyl)-1H-1,2,4-triazole-5-thione
OPENEYE Name: 4-methyl-3-(1-phenoxyethyl)-1H-1,2,4-triazole-5-thione
IUPAC Name: 4-methyl-3-(1-phenoxyethyl)-1H-1,2,4-triazole-5-thione
SYSTEMATIC NAME: 4-methyl-3-(1-phenoxyethyl)-1H-1,2,4-triazole-5-thione
MOLECULAR FORMULA: C11H13N3OS
MOLECULAR WEIGHT: 235.30542
SMILES: CC(C1=NNC(=S)N1C)OC2=CC=CC=C2
Structure:
CAS RN: 403990-82-9
CAS Name: 4-ethyl-3-(1-phenoxyethyl)-1H-1,2,4-triazole-5-thione
OPENEYE Name: 4-ethyl-3-(1-phenoxyethyl)-1H-1,2,4-triazole-5-thione
IUPAC Name: 4-ethyl-3-(1-phenoxyethyl)-1H-1,2,4-triazole-5-thione
SYSTEMATIC NAME: 4-ethyl-3-(1-phenoxyethyl)-1H-1,2,4-triazole-5-thione
MOLECULAR FORMULA: C12H15N3OS
MOLECULAR WEIGHT: 249.332
SMILES: CCN1C(=NNC1=S)C(C)OC2=CC=CC=C2
Structure:
CAS RN: 68654-63-7
CAS Name: 3,4,5-trimethoxy-N-[2-(1-pyrrolidinyl)ethyl]benzamide hydrochloride
OPENEYE Name: 3,4,5-trimethoxy-N-(2-pyrrolidin-1-ylethyl)benzamide hydrochloride
IUPAC Name: 3,4,5-trimethoxy-N-(2-pyrrolidin-1-ylethyl)benzamide hydrochloride
SYSTEMATIC NAME: 3,4,5-trimethoxy-N-(2-pyrrolidin-1-ylethyl)benzamide hydrochloride
MOLECULAR FORMULA: C16H25ClN2O4
MOLECULAR WEIGHT: 344.8337
SMILES: COC1=CC(=CC(=C1OC)OC)C(=O)NCCN2CCCC2.Cl
Structure:
CAS RN: 97702-85-7
CAS Name: N-cyclohexyl-2-(diethylamino)acetamide hydrochloride
OPENEYE Name: N-cyclohexyl-2-(diethylamino)acetamide hydrochloride
IUPAC Name: N-cyclohexyl-2-(diethylamino)acetamide hydrochloride
SYSTEMATIC NAME: N-cyclohexyl-2-(diethylamino)ethanamide hydrochloride
MOLECULAR FORMULA: C12H25ClN2O
MOLECULAR WEIGHT: 248.7927
SMILES: CCN(CC)CC(=O)NC1CCCCC1.Cl
Structure:
CAS RN: 55489-50-4
CAS Name: N-(3-bromophenyl)-2-(diethylamino)acetamide hydrochloride
OPENEYE Name: N-(3-bromophenyl)-2-(diethylamino)acetamide hydrochloride
IUPAC Name: N-(3-bromophenyl)-2-(diethylamino)acetamide hydrochloride
SYSTEMATIC NAME: N-(3-bromophenyl)-2-(diethylamino)ethanamide hydrochloride
MOLECULAR FORMULA: C12H18BrClN2O
MOLECULAR WEIGHT: 321.64112
SMILES: CCN(CC)CC(=O)NC1=CC(=CC=C1)Br.Cl
Structure:
CAS RN: 4243-98-5
CAS Name: 4-(4-methoxyphenyl)-N-[4-[oxo-(2-oxolanylmethylamino)methyl]phenyl]-4-oxanecarboxamide
OPENEYE Name: 4-(4-methoxyphenyl)-N-[4-(tetrahydrofuran-2-ylmethylcarbamoyl)phenyl]tetrahydropyran-4-carboxamide
IUPAC Name: 4-(4-methoxyphenyl)-N-[4-(oxolan-2-ylmethylcarbamoyl)phenyl]oxane-4-carboxamide
SYSTEMATIC NAME: 4-(4-methoxyphenyl)-N-[4-(oxolan-2-ylmethylcarbamoyl)phenyl]oxane-4-carboxamide
MOLECULAR FORMULA: C25H30N2O5
MOLECULAR WEIGHT: 438.5161
SMILES: COC1=CC=C(C=C1)C2(CCOCC2)C(=O)NC3=CC=C(C=C3)C(=O)NCC4CCCO4
Structure:
CAS RN: 55489-48-0
CAS Name: 2-(diethylamino)-N-(3-nitrophenyl)acetamide hydrochloride
OPENEYE Name: 2-(diethylamino)-N-(3-nitrophenyl)acetamide hydrochloride
IUPAC Name: 2-(diethylamino)-N-(3-nitrophenyl)acetamide hydrochloride
SYSTEMATIC NAME: 2-(diethylamino)-N-(3-nitrophenyl)ethanamide hydrochloride
MOLECULAR FORMULA: C12H18ClN3O3
MOLECULAR WEIGHT: 287.74262
SMILES: CCN(CC)CC(=O)NC1=CC(=CC=C1)[N+](=O)[O-].Cl
Structure:
CAS RN: 55489-47-9
CAS Name: 2-(diethylamino)-N-(3-methoxyphenyl)acetamide hydrochloride
OPENEYE Name: 2-(diethylamino)-N-(3-methoxyphenyl)acetamide hydrochloride
IUPAC Name: 2-(diethylamino)-N-(3-methoxyphenyl)acetamide hydrochloride
SYSTEMATIC NAME: 2-(diethylamino)-N-(3-methoxyphenyl)ethanamide hydrochloride
MOLECULAR FORMULA: C13H21ClN2O2
MOLECULAR WEIGHT: 272.77104
SMILES: CCN(CC)CC(=O)NC1=CC(=CC=C1)OC.Cl
Structure:
CAS RN: 66307-47-9
CAS Name: 1-(2-fluorophenoxy)-3-(4-phenyl-1-piperazinyl)-2-propanol
OPENEYE Name: 1-(2-fluorophenoxy)-3-(4-phenylpiperazin-1-yl)propan-2-ol
IUPAC Name: 1-(2-fluorophenoxy)-3-(4-phenylpiperazin-1-yl)propan-2-ol
SYSTEMATIC NAME: 1-(2-fluoranylphenoxy)-3-(4-phenylpiperazin-1-yl)propan-2-ol
MOLECULAR FORMULA: C19H23FN2O2
MOLECULAR WEIGHT: 330.396523
SMILES: C1CN(CCN1CC(COC2=CC=CC=C2F)O)C3=CC=CC=C3
Structure:
CAS RN: 72336-04-0
CAS Name: 2-(diethylamino)-N-(phenylmethyl)acetamide hydrochloride
OPENEYE Name: N-benzyl-2-(diethylamino)acetamide hydrochloride
IUPAC Name: N-benzyl-2-(diethylamino)acetamide hydrochloride
SYSTEMATIC NAME: 2-(diethylamino)-N-(phenylmethyl)ethanamide hydrochloride
MOLECULAR FORMULA: C13H21ClN2O
MOLECULAR WEIGHT: 256.77164
SMILES: CCN(CC)CC(=O)NCC1=CC=CC=C1.Cl
Structure:
CAS RN: 93805-04-0
CAS Name: 2-[(2-methyl-5-nitrophenyl)sulfonylamino]benzoic acid
OPENEYE Name: 2-[(2-methyl-5-nitro-phenyl)sulfonylamino]benzoic acid
IUPAC Name: 2-[(2-methyl-5-nitrophenyl)sulfonylamino]benzoic acid
SYSTEMATIC NAME: 2-[(2-methyl-5-nitro-phenyl)sulfonylamino]benzoic acid
MOLECULAR FORMULA: C14H12N2O6S
MOLECULAR WEIGHT: 336.31988
SMILES: CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NC2=CC=CC=C2C(=O)O
Structure:
CAS RN: 4242-94-8
CAS Name: 1-(2-fluorophenoxy)-3-[4-(phenylmethyl)-1-piperidinyl]-2-propanol
OPENEYE Name: 1-(4-benzyl-1-piperidyl)-3-(2-fluorophenoxy)propan-2-ol
IUPAC Name: 1-(4-benzylpiperidin-1-yl)-3-(2-fluorophenoxy)propan-2-ol
SYSTEMATIC NAME: 1-(2-fluoranylphenoxy)-3-[4-(phenylmethyl)piperidin-1-yl]propan-2-ol
MOLECULAR FORMULA: C21H26FNO2
MOLECULAR WEIGHT: 343.435043
SMILES: C1CN(CCC1CC2=CC=CC=C2)CC(COC3=CC=CC=C3F)O
Structure:
CAS RN: 55489-46-8
CAS Name: 2-(diethylamino)-N-(3-methylphenyl)acetamide hydrochloride
OPENEYE Name: 2-(diethylamino)-N-(m-tolyl)acetamide hydrochloride
IUPAC Name: 2-(diethylamino)-N-(3-methylphenyl)acetamide hydrochloride
SYSTEMATIC NAME: 2-(diethylamino)-N-(3-methylphenyl)ethanamide hydrochloride
MOLECULAR FORMULA: C13H21ClN2O
MOLECULAR WEIGHT: 256.77164
SMILES: CCN(CC)CC(=O)NC1=CC=CC(=C1)C.Cl
Structure:
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