CAS RN: 4929-62-8
CAS Name: N,N-diethyl-2-[2-[(4-propan-2-ylphenyl)thio]-1-benzimidazolyl]ethanamine; 2,4,6-trinitrophenol
OPENEYE Name: N,N-diethyl-2-[2-(4-isopropylphenyl)sulfanylbenzimidazol-1-yl]ethanamine; picric acid
IUPAC Name: N,N-diethyl-2-[2-(4-propan-2-ylphenyl)sulfanylbenzimidazol-1-yl]ethanamine; 2,4,6-trinitrophenol
SYSTEMATIC NAME: N,N-diethyl-2-[2-(4-propan-2-ylphenyl)sulfanylbenzimidazol-1-yl]ethanamine; 2,4,6-trinitrophenol
MOLECULAR FORMULA: C34H35N9O14S
MOLECULAR WEIGHT: 825.7586
SMILES: CCN(CC)CCN1C2=CC=CC=C2N=C1SC3=CC=C(C=C3)C(C)C.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-].C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]
Structure:
CAS RN: 4923-06-2
CAS Name: 3,5-dipyridin-4-yl-1,2,4-triazol-1-amine
OPENEYE Name: 3,5-bis(4-pyridyl)-1,2,4-triazol-1-amine
IUPAC Name: 3,5-dipyridin-4-yl-1,2,4-triazol-1-amine
SYSTEMATIC NAME: 3,5-dipyridin-4-yl-1,2,4-triazol-1-amine
MOLECULAR FORMULA: C12H10N6
MOLECULAR WEIGHT: 238.248
SMILES: C1=CN=CC=C1C2=NN(C(=N2)C3=CC=NC=C3)N
Structure:
CAS RN: 4923-03-9
CAS Name: 3-phenyl-1,2,4-triazole-1,5-diamine
OPENEYE Name: 3-phenyl-1,2,4-triazole-1,5-diamine
IUPAC Name: 3-phenyl-1,2,4-triazole-1,5-diamine
SYSTEMATIC NAME: 3-phenyl-1,2,4-triazole-1,5-diamine
MOLECULAR FORMULA: C8H9N5
MOLECULAR WEIGHT: 175.19056
SMILES: C1=CC=C(C=C1)C2=NN(C(=N2)N)N
Structure:
CAS RN: 4922-97-8
CAS Name: 3-pyridin-4-yl-1H-1,2,4-triazole-5-sulfonamide
OPENEYE Name: 3-(4-pyridyl)-1H-1,2,4-triazole-5-sulfonamide
IUPAC Name: 3-pyridin-4-yl-1H-1,2,4-triazole-5-sulfonamide
SYSTEMATIC NAME: 3-pyridin-4-yl-1H-1,2,4-triazole-5-sulfonamide
MOLECULAR FORMULA: C7H7N5O2S
MOLECULAR WEIGHT: 225.22778
SMILES: C1=CN=CC=C1C2=NNC(=N2)S(=O)(=O)N
Structure:
CAS RN: 4922-95-6
CAS Name: 1-ethyl-3-[4-(5-sulfamoyl-1H-1,2,4-triazol-3-yl)phenyl]urea
OPENEYE Name: 1-ethyl-3-[4-(5-sulfamoyl-1H-1,2,4-triazol-3-yl)phenyl]urea
IUPAC Name: 1-ethyl-3-[4-(5-sulfamoyl-1H-1,2,4-triazol-3-yl)phenyl]urea
SYSTEMATIC NAME: 1-ethyl-3-[4-(5-sulfamoyl-1H-1,2,4-triazol-3-yl)phenyl]urea
MOLECULAR FORMULA: C11H14N6O3S
MOLECULAR WEIGHT: 310.33226
SMILES: CCNC(=O)NC1=CC=C(C=C1)C2=NNC(=N2)S(=O)(=O)N
Structure:
CAS RN: 4922-94-5
CAS Name: 3-(4-aminophenyl)-1H-1,2,4-triazole-5-sulfonamide
OPENEYE Name: 3-(4-aminophenyl)-1H-1,2,4-triazole-5-sulfonamide
IUPAC Name: 3-(4-aminophenyl)-1H-1,2,4-triazole-5-sulfonamide
SYSTEMATIC NAME: 3-(4-aminophenyl)-1H-1,2,4-triazole-5-sulfonamide
MOLECULAR FORMULA: C8H9N5O2S
MOLECULAR WEIGHT: 239.25436
SMILES: C1=CC(=CC=C1C2=NNC(=N2)S(=O)(=O)N)N
Structure:
CAS RN: 4922-55-8
CAS Name: 4-oxo-4-[4-(1H-1,2,4-triazol-5-yl)anilino]butanoic acid
OPENEYE Name: 4-oxo-4-[4-(1H-1,2,4-triazol-5-yl)anilino]butanoic acid
IUPAC Name: 4-oxo-4-[4-(1H-1,2,4-triazol-5-yl)anilino]butanoic acid
SYSTEMATIC NAME: 4-oxidanylidene-4-[[4-(1H-1,2,4-triazol-5-yl)phenyl]amino]butanoic acid
MOLECULAR FORMULA: C12H12N4O3
MOLECULAR WEIGHT: 260.24868
SMILES: C1=CC(=CC=C1C2=NC=NN2)NC(=O)CCC(=O)O
Structure:
CAS RN: 4922-53-6
CAS Name: 4-(1H-1,2,4-triazol-5-yl)benzenesulfonamide
OPENEYE Name: 4-(1H-1,2,4-triazol-5-yl)benzenesulfonamide
IUPAC Name: 4-(1H-1,2,4-triazol-5-yl)benzenesulfonamide
SYSTEMATIC NAME: 4-(1H-1,2,4-triazol-5-yl)benzenesulfonamide
MOLECULAR FORMULA: C8H8N4O2S
MOLECULAR WEIGHT: 224.23972
SMILES: C1=CC(=CC=C1C2=NC=NN2)S(=O)(=O)N
Structure:
CAS RN: 4915-50-8
CAS Name: 3-(3,4-dichlorophenyl)-5-phenyl-3-pyrrolidinol hydrochloride
OPENEYE Name: 3-(3,4-dichlorophenyl)-5-phenyl-pyrrolidin-3-ol hydrochloride
IUPAC Name: 3-(3,4-dichlorophenyl)-5-phenylpyrrolidin-3-ol hydrochloride
SYSTEMATIC NAME: 3-(3,4-dichlorophenyl)-5-phenyl-pyrrolidin-3-ol hydrochloride
MOLECULAR FORMULA: C16H16Cl3NO
MOLECULAR WEIGHT: 344.66334
SMILES: C1C(NCC1(C2=CC(=C(C=C2)Cl)Cl)O)C3=CC=CC=C3.Cl
Structure:
CAS RN: 4904-00-1
CAS Name: diphenyl-[(1R,2R)-2-pyridin-4-ylcyclopropyl]methanol
OPENEYE Name: diphenyl-[(1R,2R)-2-(4-pyridyl)cyclopropyl]methanol
IUPAC Name: diphenyl-[(1R,2R)-2-pyridin-4-ylcyclopropyl]methanol
SYSTEMATIC NAME: diphenyl-[(1R,2R)-2-pyridin-4-ylcyclopropyl]methanol
MOLECULAR FORMULA: C21H19NO
MOLECULAR WEIGHT: 301.38166
SMILES: C1[C@H]([C@@H]1C(C2=CC=CC=C2)(C3=CC=CC=C3)O)C4=CC=NC=C4
Structure:
CAS RN: 4897-65-8
CAS Name: 1-[3-[4-(6-methoxy-2-phenyl-3,4-dihydronaphthalen-1-yl)phenyl]propyl]pyrrolidine hydrochloride
OPENEYE Name: 1-[3-[4-(6-methoxy-2-phenyl-3,4-dihydronaphthalen-1-yl)phenyl]propyl]pyrrolidine hydrochloride
IUPAC Name: 1-[3-[4-(6-methoxy-2-phenyl-3,4-dihydronaphthalen-1-yl)phenyl]propyl]pyrrolidine hydrochloride
SYSTEMATIC NAME: 1-[3-[4-(6-methoxy-2-phenyl-3,4-dihydronaphthalen-1-yl)phenyl]propyl]pyrrolidine hydrochloride
MOLECULAR FORMULA: C30H34ClNO
MOLECULAR WEIGHT: 460.05006
SMILES: COC1=CC2=C(C=C1)C(=C(CC2)C3=CC=CC=C3)C4=CC=C(C=C4)CCCN5CCCC5.Cl
Structure:
CAS RN: 4871-82-3
CAS Name: 1-phenyl-3-(1-piperidinyl)-2-pyrrolidinone hydrochloride
OPENEYE Name: 1-phenyl-3-(1-piperidyl)pyrrolidin-2-one hydrochloride
IUPAC Name: 1-phenyl-3-piperidin-1-ylpyrrolidin-2-one hydrochloride
SYSTEMATIC NAME: 1-phenyl-3-piperidin-1-yl-pyrrolidin-2-one hydrochloride
MOLECULAR FORMULA: C15H21ClN2O
MOLECULAR WEIGHT: 280.79304
SMILES: C1CCN(CC1)C2CCN(C2=O)C3=CC=CC=C3.Cl
Structure:
CAS RN: 4871-70-9
CAS Name: 5-methyl-6-(phenylmethyl)pyrido[2,3-d]pyrimidine-2,4-diamine
OPENEYE Name: 6-benzyl-5-methyl-pyrido[2,3-d]pyrimidine-2,4-diamine
IUPAC Name: 6-benzyl-5-methylpyrido[2,3-d]pyrimidine-2,4-diamine
SYSTEMATIC NAME: 5-methyl-6-(phenylmethyl)pyrido[2,3-d]pyrimidine-2,4-diamine
MOLECULAR FORMULA: C15H15N5
MOLECULAR WEIGHT: 265.3131
SMILES: CC1=C2C(=NC(=NC2=NC=C1CC3=CC=CC=C3)N)N
Structure:
CAS RN: 4867-79-2
CAS Name: N-pyridin-4-ylcarbamic acid (3,4,5-trimethoxyphenyl)methyl ester
OPENEYE Name: (3,4,5-trimethoxyphenyl)methyl N-(4-pyridyl)carbamate
IUPAC Name: (3,4,5-trimethoxyphenyl)methyl N-pyridin-4-ylcarbamate
SYSTEMATIC NAME: (3,4,5-trimethoxyphenyl)methyl N-pyridin-4-ylcarbamate
MOLECULAR FORMULA: C16H18N2O5
MOLECULAR WEIGHT: 318.32452
SMILES: COC1=CC(=CC(=C1OC)OC)COC(=O)NC2=CC=NC=C2
Structure:
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