Product OPENEYE NAME: 2-(7-methyl-2-methylsulfanyl-4-oxo-thieno[3,2-d]pyrimidin-3-yl)acetic acid
CAS Name: 2-[7-methyl-2-(methylthio)-4-oxo-3-thieno[3,2-d]pyrimidinyl]acetic acid
IUPAC NAME: 2-(7-methyl-2-methylsulfanyl-4-oxothieno[3,2-d]pyrimidin-3-yl)acetic acid
SYSTEMATIC NAME: 2-(7-methyl-2-methylsulfanyl-4-oxidanylidene-thieno[3,2-d]pyrimidin-3-yl)ethanoic acid
MOLECULAR FORMULA: C10H10N2O3S2
MOLECULAR WEIGHT: 270.328
SMILES: CC1=CSC2=C1N=C(N(C2=O)CC(=O)O)SC
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CAS Name:
IUPAC NAME:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C8H5N3S
MOLECULAR WEIGHT: 175.2104
SMILES: C1=CSC2=CN3C=CN=C3N=C21
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Product OPENEYE NAME: acetyl chloride; ammonia
CAS Name: acetyl chloride; ammonia
IUPAC NAME: acetyl chloride; azane
SYSTEMATIC NAME: azane; ethanoyl chloride
MOLECULAR FORMULA: C2H6ClNO
MOLECULAR WEIGHT: 95.52814
SMILES: CC(=O)Cl.N
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Product OPENEYE NAME: 3,6-dimethyl-4a,5,7,8,8a,9-hexahydro-1H-pyrrolo[2,3-g]isoquinolin-4-one
CAS Name: 3,6-dimethyl-4a,5,7,8,8a,9-hexahydro-1H-pyrrolo[2,3-g]isoquinolin-4-one
IUPAC NAME: 3,6-dimethyl-4a,5,7,8,8a,9-hexahydro-1H-pyrrolo[2,3-g]isoquinolin-4-one
SYSTEMATIC NAME: 3,6-dimethyl-4a,5,7,8,8a,9-hexahydro-1H-pyrrolo[2,3-g]isoquinolin-4-one
MOLECULAR FORMULA: C13H18N2O
MOLECULAR WEIGHT: 218.29482
SMILES: CC1=CNC2=C1C(=O)C3CN(CCC3C2)C
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Product OPENEYE NAME: 3-ethyl-2-methyl-6-pentyl-4a,5,7,8,8a,9-hexahydro-1H-pyrrolo[2,3-g]isoquinolin-4-one
CAS Name: 3-ethyl-2-methyl-6-pentyl-4a,5,7,8,8a,9-hexahydro-1H-pyrrolo[2,3-g]isoquinolin-4-one
IUPAC NAME: 3-ethyl-2-methyl-6-pentyl-4a,5,7,8,8a,9-hexahydro-1H-pyrrolo[2,3-g]isoquinolin-4-one
SYSTEMATIC NAME: 3-ethyl-2-methyl-6-pentyl-4a,5,7,8,8a,9-hexahydro-1H-pyrrolo[2,3-g]isoquinolin-4-one
MOLECULAR FORMULA: C19H30N2O
MOLECULAR WEIGHT: 302.4543
SMILES: CCCCCN1CCC2CC3=C(C(=C(N3)C)CC)C(=O)C2C1
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Product OPENEYE NAME: 3-ethyl-2-methyl-6-(2-pyrrolidin-1-ylethyl)-4a,5,7,8,8a,9-hexahydro-1H-pyrrolo[2,3-g]isoquinolin-4-one
CAS Name: 3-ethyl-2-methyl-6-[2-(1-pyrrolidinyl)ethyl]-4a,5,7,8,8a,9-hexahydro-1H-pyrrolo[2,3-g]isoquinolin-4-one
IUPAC NAME: 3-ethyl-2-methyl-6-(2-pyrrolidin-1-ylethyl)-4a,5,7,8,8a,9-hexahydro-1H-pyrrolo[2,3-g]isoquinolin-4-one
SYSTEMATIC NAME: 3-ethyl-2-methyl-6-(2-pyrrolidin-1-ylethyl)-4a,5,7,8,8a,9-hexahydro-1H-pyrrolo[2,3-g]isoquinolin-4-one
MOLECULAR FORMULA: C20H31N3O
MOLECULAR WEIGHT: 329.47964
SMILES: CCC1=C(NC2=C1C(=O)C3CN(CCC3C2)CCN4CCCC4)C
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Product OPENEYE NAME: 3-ethyl-6-(2-hydroxy-2-phenyl-ethyl)-2-methyl-4a,5,7,8,8a,9-hexahydro-1H-pyrrolo[2,3-g]isoquinoline-4-thione
CAS Name: 3-ethyl-6-(2-hydroxy-2-phenylethyl)-2-methyl-4a,5,7,8,8a,9-hexahydro-1H-pyrrolo[2,3-g]isoquinoline-4-thione
IUPAC NAME: 3-ethyl-6-(2-hydroxy-2-phenylethyl)-2-methyl-4a,5,7,8,8a,9-hexahydro-1H-pyrrolo[2,3-g]isoquinoline-4-thione
SYSTEMATIC NAME: 3-ethyl-2-methyl-6-(2-oxidanyl-2-phenyl-ethyl)-4a,5,7,8,8a,9-hexahydro-1H-pyrrolo[2,3-g]isoquinoline-4-thione
MOLECULAR FORMULA: C22H28N2OS
MOLECULAR WEIGHT: 368.53552
SMILES: CCC1=C(NC2=C1C(=S)C3CN(CCC3C2)CC(C4=CC=CC=C4)O)C
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Product OPENEYE NAME: (3,5-dimethoxyphenyl)-ethyl-carbamic acid
CAS Name: (3,5-dimethoxyphenyl)-ethylcarbamic acid
IUPAC NAME: (3,5-dimethoxyphenyl)-ethylcarbamic acid
SYSTEMATIC NAME: (3,5-dimethoxyphenyl)-ethyl-carbamic acid
MOLECULAR FORMULA: C11H15NO4
MOLECULAR WEIGHT: 225.2411
SMILES: CCN(C1=CC(=CC(=C1)OC)OC)C(=O)O
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Product OPENEYE NAME: (2E)-2-hydroxyiminoheptan-3-one
CAS Name: (2E)-2-hydroxyimino-3-heptanone
IUPAC NAME: (2E)-2-hydroxyiminoheptan-3-one
SYSTEMATIC NAME: (2E)-2-hydroxyiminoheptan-3-one
MOLECULAR FORMULA: C7H13NO2
MOLECULAR WEIGHT: 143.18362
SMILES: CCCCC(=O)/C(=N/O)/C
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Product OPENEYE NAME: 3-ethyl-6-heptyl-2-methyl-4a,5,7,8,8a,9-hexahydro-1H-pyrrolo[2,3-g]isoquinolin-4-one
CAS Name: 3-ethyl-6-heptyl-2-methyl-4a,5,7,8,8a,9-hexahydro-1H-pyrrolo[2,3-g]isoquinolin-4-one
IUPAC NAME: 3-ethyl-6-heptyl-2-methyl-4a,5,7,8,8a,9-hexahydro-1H-pyrrolo[2,3-g]isoquinolin-4-one
SYSTEMATIC NAME: 3-ethyl-6-heptyl-2-methyl-4a,5,7,8,8a,9-hexahydro-1H-pyrrolo[2,3-g]isoquinolin-4-one
MOLECULAR FORMULA: C21H34N2O
MOLECULAR WEIGHT: 330.50746
SMILES: CCCCCCCN1CCC2CC3=C(C(=C(N3)C)CC)C(=O)C2C1
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Product OPENEYE NAME: (2Z)-1-cyclopropyl-2-hydroxyimino-propan-1-one
CAS Name: (2Z)-1-cyclopropyl-2-hydroxyimino-1-propanone
IUPAC NAME: (2Z)-1-cyclopropyl-2-hydroxyiminopropan-1-one
SYSTEMATIC NAME: (2Z)-1-cyclopropyl-2-hydroxyimino-propan-1-one
MOLECULAR FORMULA: C6H9NO2
MOLECULAR WEIGHT: 127.14116
SMILES: C/C(=N/O)/C(=O)C1CC1
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Product OPENEYE NAME: 1,3a,4a,5,6,7,8,8a,9,9a-decahydropyrrolo[2,3-g]isoquinolin-4-one
CAS Name: 1,3a,4a,5,6,7,8,8a,9,9a-decahydropyrrolo[2,3-g]isoquinolin-4-one
IUPAC NAME: 1,3a,4a,5,6,7,8,8a,9,9a-decahydropyrrolo[2,3-g]isoquinolin-4-one
SYSTEMATIC NAME: 1,3a,4a,5,6,7,8,8a,9,9a-decahydropyrrolo[2,3-g]isoquinolin-4-one
MOLECULAR FORMULA: C11H16N2O
MOLECULAR WEIGHT: 192.25754
SMILES: C1CNCC2C1CC3C(C2=O)C=CN3
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Product OPENEYE NAME: N-ethyl-3,5-dimethoxy-N-methyl-aniline hydrochloride
CAS Name: N-ethyl-3,5-dimethoxy-N-methylaniline hydrochloride
IUPAC NAME: N-ethyl-3,5-dimethoxy-N-methylaniline hydrochloride
SYSTEMATIC NAME: N-ethyl-3,5-dimethoxy-N-methyl-aniline hydrochloride
MOLECULAR FORMULA: C11H18ClNO2
MOLECULAR WEIGHT: 231.71912
SMILES: CCN(C)C1=CC(=CC(=C1)OC)OC.Cl
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Product OPENEYE NAME: N-ethyl-3,5-dimethoxy-N-methyl-aniline
CAS Name: N-ethyl-3,5-dimethoxy-N-methylaniline
IUPAC NAME: N-ethyl-3,5-dimethoxy-N-methylaniline
SYSTEMATIC NAME: N-ethyl-3,5-dimethoxy-N-methyl-aniline
MOLECULAR FORMULA: C11H17NO2
MOLECULAR WEIGHT: 195.25818
SMILES: CCN(C)C1=CC(=CC(=C1)OC)OC
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