CAS RN: 15264-63-8
CAS Name: 5-pyridin-4-yl-3H-1,3,4-oxadiazole-2-thione
OPENEYE Name: 5-(4-pyridyl)-3H-1,3,4-oxadiazole-2-thione
IUPAC Name: 5-pyridin-4-yl-3H-1,3,4-oxadiazole-2-thione
SYSTEMATIC NAME: 5-pyridin-4-yl-3H-1,3,4-oxadiazole-2-thione
MOLECULAR FORMULA: C7H5N3OS
MOLECULAR WEIGHT: 179.1991
SMILES: C1=CN=CC=C1C2=NNC(=S)O2
Structure:
CAS RN: 2381-75-1
CAS Name: 2-(4-chlorophenoxy)acetohydrazide
OPENEYE Name: 2-(4-chlorophenoxy)acetohydrazide
IUPAC Name: 2-(4-chlorophenoxy)acetohydrazide
SYSTEMATIC NAME: 2-(4-chloranylphenoxy)ethanehydrazide
MOLECULAR FORMULA: C8H9ClN2O2
MOLECULAR WEIGHT: 200.62226
SMILES: C1=CC(=CC=C1OCC(=O)NN)Cl
Structure:
CAS RN: 23917-54-6
CAS Name: 2-(4-chlorophenoxy)acetohydrazide
OPENEYE Name: 2-(4-chlorophenoxy)acetohydrazide
IUPAC Name: 2-(4-chlorophenoxy)acetohydrazide
SYSTEMATIC NAME: 2-(4-chloranylphenoxy)ethanehydrazide
MOLECULAR FORMULA: C8H9ClN2O2
MOLECULAR WEIGHT: 200.62226
SMILES: C1=CC(=CC=C1OCC(=O)NN)Cl
Structure:
CAS RN: 82126-64-5
CAS Name: (Z)-3-(2,5-dimethoxyphenyl)-2-(4-nitrophenyl)-2-propenenitrile
OPENEYE Name: (Z)-3-(2,5-dimethoxyphenyl)-2-(4-nitrophenyl)prop-2-enenitrile
IUPAC Name: (Z)-3-(2,5-dimethoxyphenyl)-2-(4-nitrophenyl)prop-2-enenitrile
SYSTEMATIC NAME: (Z)-3-(2,5-dimethoxyphenyl)-2-(4-nitrophenyl)prop-2-enenitrile
MOLECULAR FORMULA: C17H14N2O4
MOLECULAR WEIGHT: 310.30406
SMILES: COC1=CC(=C(C=C1)OC)/C=C(\C#N)/C2=CC=C(C=C2)[N+](=O)[O-]
Structure:
CAS RN: 80777-97-5
CAS Name: (Z)-3-(2,5-dimethoxyphenyl)-2-(4-nitrophenyl)-2-propenenitrile
OPENEYE Name: (Z)-3-(2,5-dimethoxyphenyl)-2-(4-nitrophenyl)prop-2-enenitrile
IUPAC Name: (Z)-3-(2,5-dimethoxyphenyl)-2-(4-nitrophenyl)prop-2-enenitrile
SYSTEMATIC NAME: (Z)-3-(2,5-dimethoxyphenyl)-2-(4-nitrophenyl)prop-2-enenitrile
MOLECULAR FORMULA: C17H14N2O4
MOLECULAR WEIGHT: 310.30406
SMILES: COC1=CC(=C(C=C1)OC)/C=C(\C#N)/C2=CC=C(C=C2)[N+](=O)[O-]
Structure:
CAS RN: 55118-85-9
CAS Name: 2-[(4-chloroanilino)methylidene]-5,5-dimethylcyclohexane-1,3-dione
OPENEYE Name: 2-[(4-chloroanilino)methylene]-5,5-dimethyl-cyclohexane-1,3-dione
IUPAC Name: 2-[(4-chloroanilino)methylidene]-5,5-dimethylcyclohexane-1,3-dione
SYSTEMATIC NAME: 2-[[(4-chlorophenyl)amino]methylidene]-5,5-dimethyl-cyclohexane-1,3-dione
MOLECULAR FORMULA: C15H16ClNO2
MOLECULAR WEIGHT: 277.74604
SMILES: CC1(CC(=O)C(=CNC2=CC=C(C=C2)Cl)C(=O)C1)C
Structure:
CAS RN: 87559-65-7
CAS Name: 1,2,4-trimethoxy-5-[(E)-2-nitroethenyl]benzene
OPENEYE Name: 1,2,4-trimethoxy-5-[(E)-2-nitrovinyl]benzene
IUPAC Name: 1,2,4-trimethoxy-5-[(E)-2-nitroethenyl]benzene
SYSTEMATIC NAME: 1,2,4-trimethoxy-5-[(E)-2-nitroethenyl]benzene
MOLECULAR FORMULA: C11H13NO5
MOLECULAR WEIGHT: 239.22462
SMILES: COC1=CC(=C(C=C1/C=C/[N+](=O)[O-])OC)OC
Structure:
CAS RN: 5950-43-6
CAS Name: 2-(4-methyl-3-nitrophenyl)-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one
OPENEYE Name: 2-(4-methyl-3-nitro-phenyl)-5,6,7,8-tetrahydro-3H-benzothiopheno[2,3-d]pyrimidin-4-one
IUPAC Name: 2-(4-methyl-3-nitrophenyl)-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one
SYSTEMATIC NAME: 2-(4-methyl-3-nitro-phenyl)-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one
MOLECULAR FORMULA: C17H15N3O3S
MOLECULAR WEIGHT: 341.3843
SMILES: CC1=C(C=C(C=C1)C2=NC3=C(C4=C(S3)CCCC4)C(=O)N2)[N+](=O)[O-]
Structure:
CAS RN: 131172-64-0
CAS Name: 4,5,6,7-tetrahydro-1H-indole-2-carboxylic acid
OPENEYE Name: 4,5,6,7-tetrahydro-1H-indole-2-carboxylic acid
IUPAC Name: 4,5,6,7-tetrahydro-1H-indole-2-carboxylic acid
SYSTEMATIC NAME: 4,5,6,7-tetrahydro-1H-indole-2-carboxylic acid
MOLECULAR FORMULA: C9H11NO2
MOLECULAR WEIGHT: 165.18914
SMILES: C1CCC2=C(C1)C=C(N2)C(=O)O
Structure:
CAS RN: 120354-24-7
CAS Name: 3-amino-2-(phenylmethyl)-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one
OPENEYE Name: 3-amino-2-benzyl-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-4-one
IUPAC Name: 3-amino-2-benzyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one
SYSTEMATIC NAME: 3-azanyl-2-(phenylmethyl)-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one
MOLECULAR FORMULA: C17H17N3OS
MOLECULAR WEIGHT: 311.40138
SMILES: C1CCC2=C(C1)C3=C(S2)N=C(N(C3=O)N)CC4=CC=CC=C4
Structure:
CAS RN: 327049-95-6
CAS Name: 5-(2-bromo-4-nitrophenyl)-2-furancarboxaldehyde
OPENEYE Name: 5-(2-bromo-4-nitro-phenyl)furan-2-carbaldehyde
IUPAC Name: 5-(2-bromo-4-nitrophenyl)furan-2-carbaldehyde
SYSTEMATIC NAME: 5-(2-bromanyl-4-nitro-phenyl)furan-2-carbaldehyde
MOLECULAR FORMULA: C11H6BrNO4
MOLECULAR WEIGHT: 296.07364
SMILES: C1=CC(=C(C=C1[N+](=O)[O-])Br)C2=CC=C(O2)C=O
Structure:
CAS RN: 352455-50-6
CAS Name: 3-ethoxy-4-[(4-fluorophenyl)methoxy]benzaldehyde
OPENEYE Name: 3-ethoxy-4-[(4-fluorophenyl)methoxy]benzaldehyde
IUPAC Name: 3-ethoxy-4-[(4-fluorophenyl)methoxy]benzaldehyde
SYSTEMATIC NAME: 3-ethoxy-4-[(4-fluorophenyl)methoxy]benzaldehyde
MOLECULAR FORMULA: C16H15FO3
MOLECULAR WEIGHT: 274.286903
SMILES: CCOC1=C(C=CC(=C1)C=O)OCC2=CC=C(C=C2)F
Structure:
CAS RN: 312585-47-0
CAS Name: N-(1,5-dihydro-2,4-benzodioxepin-3-ylmethyl)-4-methoxyaniline
OPENEYE Name: N-(1,5-dihydro-2,4-benzodioxepin-3-ylmethyl)-4-methoxy-aniline
IUPAC Name: N-(1,5-dihydro-2,4-benzodioxepin-3-ylmethyl)-4-methoxyaniline
SYSTEMATIC NAME: N-(1,5-dihydro-2,4-benzodioxepin-3-ylmethyl)-4-methoxy-aniline
MOLECULAR FORMULA: C17H19NO3
MOLECULAR WEIGHT: 285.33766
SMILES: COC1=CC=C(C=C1)NCC2OCC3=CC=CC=C3CO2
Structure:
CAS RN: 5931-97-5
CAS Name: 3-methyl-1-[4-[(2-nitrophenyl)methyl]-1-piperazinyl]-1-butanone
OPENEYE Name: 3-methyl-1-[4-[(2-nitrophenyl)methyl]piperazin-1-yl]butan-1-one
IUPAC Name: 3-methyl-1-[4-[(2-nitrophenyl)methyl]piperazin-1-yl]butan-1-one
SYSTEMATIC NAME: 3-methyl-1-[4-[(2-nitrophenyl)methyl]piperazin-1-yl]butan-1-one
MOLECULAR FORMULA: C16H23N3O3
MOLECULAR WEIGHT: 305.37212
SMILES: CC(C)CC(=O)N1CCN(CC1)CC2=CC=CC=C2[N+](=O)[O-]
Structure:
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