CAS RN: 3160-35-8
CAS Name: (E)-4-(4-hydroxyphenyl)-3-buten-2-one
OPENEYE Name: (E)-4-(4-hydroxyphenyl)but-3-en-2-one
IUPAC Name: (E)-4-(4-hydroxyphenyl)but-3-en-2-one
SYSTEMATIC NAME: (E)-4-(4-hydroxyphenyl)but-3-en-2-one
MOLECULAR FORMULA: C10H10O2
MOLECULAR WEIGHT: 162.1852
SMILES: CC(=O)/C=C/C1=CC=C(C=C1)O
Structure:
CAS RN: 22214-30-8
CAS Name: (E)-4-(4-hydroxyphenyl)-3-buten-2-one
OPENEYE Name: (E)-4-(4-hydroxyphenyl)but-3-en-2-one
IUPAC Name: (E)-4-(4-hydroxyphenyl)but-3-en-2-one
SYSTEMATIC NAME: (E)-4-(4-hydroxyphenyl)but-3-en-2-one
MOLECULAR FORMULA: C10H10O2
MOLECULAR WEIGHT: 162.1852
SMILES: CC(=O)/C=C/C1=CC=C(C=C1)O
Structure:
CAS RN: 57130-80-0
CAS Name: 1-[[4-(1-benzimidazolylmethyl)-1-piperazinyl]methyl]benzimidazole
OPENEYE Name: 1-[[4-(benzimidazol-1-ylmethyl)piperazin-1-yl]methyl]benzimidazole
IUPAC Name: 1-[[4-(benzimidazol-1-ylmethyl)piperazin-1-yl]methyl]benzimidazole
SYSTEMATIC NAME: 1-[[4-(benzimidazol-1-ylmethyl)piperazin-1-yl]methyl]benzimidazole
MOLECULAR FORMULA: C20H22N6
MOLECULAR WEIGHT: 346.42888
SMILES: C1CN(CCN1CN2C=NC3=CC=CC=C32)CN4C=NC5=CC=CC=C54
Structure:
CAS RN: 51516-70-2
CAS Name: 2,4-dichloro-N-(2,4-dimethylphenyl)benzamide
OPENEYE Name: 2,4-dichloro-N-(2,4-dimethylphenyl)benzamide
IUPAC Name: 2,4-dichloro-N-(2,4-dimethylphenyl)benzamide
SYSTEMATIC NAME: 2,4-bis(chloranyl)-N-(2,4-dimethylphenyl)benzamide
MOLECULAR FORMULA: C15H13Cl2NO
MOLECULAR WEIGHT: 294.17582
SMILES: CC1=CC(=C(C=C1)NC(=O)C2=C(C=C(C=C2)Cl)Cl)C
Structure:
CAS RN: 15863-19-1
CAS Name: 1-cyclohexyl-3-(4-methylphenyl)thiourea
OPENEYE Name: 1-cyclohexyl-3-(p-tolyl)thiourea
IUPAC Name: 1-cyclohexyl-3-(4-methylphenyl)thiourea
SYSTEMATIC NAME: 1-cyclohexyl-3-(4-methylphenyl)thiourea
MOLECULAR FORMULA: C14H20N2S
MOLECULAR WEIGHT: 248.387
SMILES: CC1=CC=C(C=C1)NC(=S)NC2CCCCC2
Structure:
CAS RN: 52196-90-4
CAS Name: 5-(phenylmethyl)-3-pyridinol
OPENEYE Name: 5-benzylpyridin-3-ol
IUPAC Name: 5-benzylpyridin-3-ol
SYSTEMATIC NAME: 5-(phenylmethyl)pyridin-3-ol
MOLECULAR FORMULA: C12H11NO
MOLECULAR WEIGHT: 185.22184
SMILES: C1=CC=C(C=C1)CC2=CC(=CN=C2)O
Structure:
CAS RN: 55119-09-0
CAS Name: 1-(4-chlorophenyl)-5-(2,4-dichlorophenyl)-1,2,4-triazole
OPENEYE Name: 1-(4-chlorophenyl)-5-(2,4-dichlorophenyl)-1,2,4-triazole
IUPAC Name: 1-(4-chlorophenyl)-5-(2,4-dichlorophenyl)-1,2,4-triazole
SYSTEMATIC NAME: 1-(4-chlorophenyl)-5-(2,4-dichlorophenyl)-1,2,4-triazole
MOLECULAR FORMULA: C14H8Cl3N3
MOLECULAR WEIGHT: 324.59242
SMILES: C1=CC(=CC=C1N2C(=NC=N2)C3=C(C=C(C=C3)Cl)Cl)Cl
Structure:
CAS RN: 1698-64-2
CAS Name: 4,5-dichloro-2-phenyl-1H-pyridazine-3,6-dione
OPENEYE Name: 4,5-dichloro-2-phenyl-1H-pyridazine-3,6-dione
IUPAC Name: 4,5-dichloro-2-phenyl-1H-pyridazine-3,6-dione
SYSTEMATIC NAME: 4,5-bis(chloranyl)-2-phenyl-1H-pyridazine-3,6-dione
MOLECULAR FORMULA: C10H6Cl2N2O2
MOLECULAR WEIGHT: 257.07284
SMILES: C1=CC=C(C=C1)N2C(=O)C(=C(C(=O)N2)Cl)Cl
Structure:
CAS RN: 435345-44-1
CAS Name: 2,2-diphenyl-1-(1-piperazinyl)ethanone
OPENEYE Name: 2,2-diphenyl-1-piperazin-1-yl-ethanone
IUPAC Name: 2,2-diphenyl-1-piperazin-1-ylethanone
SYSTEMATIC NAME: 2,2-diphenyl-1-piperazin-1-yl-ethanone
MOLECULAR FORMULA: C18H20N2O
MOLECULAR WEIGHT: 280.3642
SMILES: C1CN(CCN1)C(=O)C(C2=CC=CC=C2)C3=CC=CC=C3
Structure:
CAS RN: 70931-28-1
CAS Name: 1-[(4-fluorophenyl)methyl]piperazine
OPENEYE Name: 1-[(4-fluorophenyl)methyl]piperazine
IUPAC Name: 1-[(4-fluorophenyl)methyl]piperazine
SYSTEMATIC NAME: 1-[(4-fluorophenyl)methyl]piperazine
MOLECULAR FORMULA: C11H15FN2
MOLECULAR WEIGHT: 194.248603
SMILES: C1CN(CCN1)CC2=CC=C(C=C2)F
Structure:
CAS RN: 55455-92-0
CAS Name: 1-(3-phenylpropyl)piperazine
OPENEYE Name: 1-(3-phenylpropyl)piperazine
IUPAC Name: 1-(3-phenylpropyl)piperazine
SYSTEMATIC NAME: 1-(3-phenylpropyl)piperazine
MOLECULAR FORMULA: C13H20N2
MOLECULAR WEIGHT: 204.3113
SMILES: C1CN(CCN1)CCCC2=CC=CC=C2
Structure:
CAS RN: 21988-66-9
CAS Name: 1-[(4-ethoxyphenyl)methyl]piperazine
OPENEYE Name: 1-[(4-ethoxyphenyl)methyl]piperazine
IUPAC Name: 1-[(4-ethoxyphenyl)methyl]piperazine
SYSTEMATIC NAME: 1-[(4-ethoxyphenyl)methyl]piperazine
MOLECULAR FORMULA: C13H20N2O
MOLECULAR WEIGHT: 220.3107
SMILES: CCOC1=CC=C(C=C1)CN2CCNCC2
Structure:
CAS RN: 223785-97-5
CAS Name: 1-methyl-4-(4-nitrophenyl)sulfonylpiperazine
OPENEYE Name: 1-methyl-4-(4-nitrophenyl)sulfonyl-piperazine
IUPAC Name: 1-methyl-4-(4-nitrophenyl)sulfonylpiperazine
SYSTEMATIC NAME: 1-methyl-4-(4-nitrophenyl)sulfonyl-piperazine
MOLECULAR FORMULA: C11H15N3O4S
MOLECULAR WEIGHT: 285.3195
SMILES: CN1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]
Structure:
CAS RN: 159222-24-9
CAS Name: 2-[(1-methyl-2-benzimidazolyl)thio]acetic acid
OPENEYE Name: 2-(1-methylbenzimidazol-2-yl)sulfanylacetic acid
IUPAC Name: 2-(1-methylbenzimidazol-2-yl)sulfanylacetic acid
SYSTEMATIC NAME: 2-(1-methylbenzimidazol-2-yl)sulfanylethanoic acid
MOLECULAR FORMULA: C10H10N2O2S
MOLECULAR WEIGHT: 222.2636
SMILES: CN1C2=CC=CC=C2N=C1SCC(=O)O
Structure:
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