CAS RN: 1208-64-6
CAS Name: 3-(4-tert-butylphenyl)propanoic acid
OPENEYE Name: 3-(4-tert-butylphenyl)propanoic acid
IUPAC Name: 3-(4-tert-butylphenyl)propanoic acid
SYSTEMATIC NAME: 3-(4-tert-butylphenyl)propanoic acid
MOLECULAR FORMULA: C13H18O2
MOLECULAR WEIGHT: 206.28082
SMILES: CC(C)(C)C1=CC=C(C=C1)CCC(=O)O
Structure:
CAS RN: 69321-56-8
CAS Name: 5-bromo-2-methylbenzenesulfonyl chloride
OPENEYE Name: 5-bromo-2-methyl-benzenesulfonyl chloride
IUPAC Name: 5-bromo-2-methylbenzenesulfonyl chloride
SYSTEMATIC NAME: 5-bromanyl-2-methyl-benzenesulfonyl chloride
MOLECULAR FORMULA: C7H6BrClO2S
MOLECULAR WEIGHT: 269.54334
SMILES: CC1=C(C=C(C=C1)Br)S(=O)(=O)Cl
Structure:
CAS RN: 25700-10-1
CAS Name: 1-[4-(1-benzimidazolyl)phenyl]ethanone
OPENEYE Name: 1-[4-(benzimidazol-1-yl)phenyl]ethanone
IUPAC Name: 1-[4-(benzimidazol-1-yl)phenyl]ethanone
SYSTEMATIC NAME: 1-[4-(benzimidazol-1-yl)phenyl]ethanone
MOLECULAR FORMULA: C15H12N2O
MOLECULAR WEIGHT: 236.26858
SMILES: CC(=O)C1=CC=C(C=C1)N2C=NC3=CC=CC=C32
Structure:
CAS RN: 89102-54-5
CAS Name: 4-(2-bromo-1-oxoethyl)-N,N-dimethylbenzenesulfonamide
OPENEYE Name: 4-(2-bromoacetyl)-N,N-dimethyl-benzenesulfonamide
IUPAC Name: 4-(2-bromoacetyl)-N,N-dimethylbenzenesulfonamide
SYSTEMATIC NAME: 4-(2-bromanylethanoyl)-N,N-dimethyl-benzenesulfonamide
MOLECULAR FORMULA: C10H12BrNO3S
MOLECULAR WEIGHT: 306.17618
SMILES: CN(C)S(=O)(=O)C1=CC=C(C=C1)C(=O)CBr
Structure:
CAS RN: 103026-12-6
CAS Name: 7-(2-furanylmethyl)-5,6-dimethyl-4-pyrrolo[2,3-d]pyrimidinamine
OPENEYE Name: 7-(2-furylmethyl)-5,6-dimethyl-pyrrolo[2,3-d]pyrimidin-4-amine
IUPAC Name: 7-(furan-2-ylmethyl)-5,6-dimethylpyrrolo[2,3-d]pyrimidin-4-amine
SYSTEMATIC NAME: 7-(furan-2-ylmethyl)-5,6-dimethyl-pyrrolo[2,3-d]pyrimidin-4-amine
MOLECULAR FORMULA: C13H14N4O
MOLECULAR WEIGHT: 242.27646
SMILES: CC1=C(N(C2=C1C(=NC=N2)N)CC3=CC=CO3)C
Structure:
CAS RN: 72578-38-2
CAS Name: 2-amino-1-(4-methoxyphenyl)-4,5-dimethyl-3-pyrrolecarbonitrile
OPENEYE Name: 2-amino-1-(4-methoxyphenyl)-4,5-dimethyl-pyrrole-3-carbonitrile
IUPAC Name: 2-amino-1-(4-methoxyphenyl)-4,5-dimethylpyrrole-3-carbonitrile
SYSTEMATIC NAME: 2-azanyl-1-(4-methoxyphenyl)-4,5-dimethyl-pyrrole-3-carbonitrile
MOLECULAR FORMULA: C14H15N3O
MOLECULAR WEIGHT: 241.2884
SMILES: CC1=C(N(C(=C1C#N)N)C2=CC=C(C=C2)OC)C
Structure:
CAS RN: 72578-53-1
CAS Name: 2-amino-4,5-dimethyl-1-(4-methylphenyl)-3-pyrrolecarbonitrile
OPENEYE Name: 2-amino-4,5-dimethyl-1-(p-tolyl)pyrrole-3-carbonitrile
IUPAC Name: 2-amino-4,5-dimethyl-1-(4-methylphenyl)pyrrole-3-carbonitrile
SYSTEMATIC NAME: 2-azanyl-4,5-dimethyl-1-(4-methylphenyl)pyrrole-3-carbonitrile
MOLECULAR FORMULA: C14H15N3
MOLECULAR WEIGHT: 225.289
SMILES: CC1=CC=C(C=C1)N2C(=C(C(=C2N)C#N)C)C
Structure:
CAS RN: 53088-07-6
CAS Name: N-(2-chlorophenyl)-1,3-benzothiazol-2-amine
OPENEYE Name: N-(2-chlorophenyl)-1,3-benzothiazol-2-amine
IUPAC Name: N-(2-chlorophenyl)-1,3-benzothiazol-2-amine
SYSTEMATIC NAME: N-(2-chlorophenyl)-1,3-benzothiazol-2-amine
MOLECULAR FORMULA: C13H9ClN2S
MOLECULAR WEIGHT: 260.74196
SMILES: C1=CC=C2C(=C1)N=C(S2)NC3=CC=CC=C3Cl
Structure:
CAS RN: 84772-16-7
CAS Name: 3-(2,3-dimethylphenyl)-2-hydrazinyl-4-quinazolinone
OPENEYE Name: 3-(2,3-dimethylphenyl)-2-hydrazino-quinazolin-4-one
IUPAC Name: 3-(2,3-dimethylphenyl)-2-hydrazinylquinazolin-4-one
SYSTEMATIC NAME: 2-diazanyl-3-(2,3-dimethylphenyl)quinazolin-4-one
MOLECULAR FORMULA: C16H16N4O
MOLECULAR WEIGHT: 280.32444
SMILES: CC1=C(C(=CC=C1)N2C(=O)C3=CC=CC=C3N=C2NN)C
Structure:
CAS RN: 77066-13-8
CAS Name: 3-(2,4-dimethylphenyl)-2-hydrazinyl-4-quinazolinone
OPENEYE Name: 3-(2,4-dimethylphenyl)-2-hydrazino-quinazolin-4-one
IUPAC Name: 3-(2,4-dimethylphenyl)-2-hydrazinylquinazolin-4-one
SYSTEMATIC NAME: 2-diazanyl-3-(2,4-dimethylphenyl)quinazolin-4-one
MOLECULAR FORMULA: C16H16N4O
MOLECULAR WEIGHT: 280.32444
SMILES: CC1=CC(=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2NN)C
Structure:
CAS RN: 120456-32-8
CAS Name: 5-acetyl-2-hydroxy-4-methyl-3-thiophenecarbonitrile
OPENEYE Name: 5-acetyl-2-hydroxy-4-methyl-thiophene-3-carbonitrile
IUPAC Name: 5-acetyl-2-hydroxy-4-methylthiophene-3-carbonitrile
SYSTEMATIC NAME: 5-ethanoyl-4-methyl-2-oxidanyl-thiophene-3-carbonitrile
MOLECULAR FORMULA: C8H7NO2S
MOLECULAR WEIGHT: 181.21168
SMILES: CC1=C(SC(=C1C#N)O)C(=O)C
Structure:
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