CAS RN: 67668-14-8
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C15H10O2S3
MOLECULAR WEIGHT: 318.4337
SMILES: CC1=CC2=C(C3=S(S2)SC(=C3)C4=CC=CC=C4)C(=O)O1
Structure:
CAS RN: 70625-15-9
CAS Name: 3-hydroxy-4-(1-oxido-3,4-dihydro-2H-pyrrol-1-ium-2-yl)butanenitrile
OPENEYE Name: 3-hydroxy-4-(1-oxido-3,4-dihydro-2H-pyrrol-1-ium-2-yl)butanenitrile
IUPAC Name: 3-hydroxy-4-(1-oxido-3,4-dihydro-2H-pyrrol-1-ium-2-yl)butanenitrile
SYSTEMATIC NAME: 4-(1-oxidanidyl-3,4-dihydro-2H-pyrrol-1-ium-2-yl)-3-oxidanyl-butanenitrile
MOLECULAR FORMULA: C8H12N2O2
MOLECULAR WEIGHT: 168.19308
SMILES: C1CC([N+](=C1)[O-])CC(CC#N)O
Structure:
CAS RN: 60463-77-6
CAS Name: 3-hydroxy-1-methyl-3-phenacyl-2-indolone
OPENEYE Name: 3-hydroxy-1-methyl-3-phenacyl-indolin-2-one
IUPAC Name: 3-hydroxy-1-methyl-3-phenacylindol-2-one
SYSTEMATIC NAME: 1-methyl-3-oxidanyl-3-phenacyl-indol-2-one
MOLECULAR FORMULA: C17H15NO3
MOLECULAR WEIGHT: 281.3059
SMILES: CN1C2=CC=CC=C2C(C1=O)(CC(=O)C3=CC=CC=C3)O
Structure:
CAS RN: 57725-30-1
CAS Name: 1-methyl-4-[[4-(4-propan-2-yl-1-piperazinyl)-3-pyridinyl]sulfonyl]piperazine
OPENEYE Name: 1-[[4-(4-isopropylpiperazin-1-yl)-3-pyridyl]sulfonyl]-4-methyl-piperazine
IUPAC Name: 1-methyl-4-[4-(4-propan-2-ylpiperazin-1-yl)pyridin-3-yl]sulfonylpiperazine
SYSTEMATIC NAME: 1-methyl-4-[4-(4-propan-2-ylpiperazin-1-yl)pyridin-3-yl]sulfonyl-piperazine
MOLECULAR FORMULA: C17H29N5O2S
MOLECULAR WEIGHT: 367.50946
SMILES: CC(C)N1CCN(CC1)C2=C(C=NC=C2)S(=O)(=O)N3CCN(CC3)C
Structure:
CAS RN: 57725-27-6
CAS Name: 1-propan-2-yl-4-[3-(1-pyrrolidinylsulfonyl)-4-pyridinyl]piperazine
OPENEYE Name: 1-isopropyl-4-(3-pyrrolidin-1-ylsulfonyl-4-pyridyl)piperazine
IUPAC Name: 1-propan-2-yl-4-(3-pyrrolidin-1-ylsulfonylpyridin-4-yl)piperazine
SYSTEMATIC NAME: 1-propan-2-yl-4-(3-pyrrolidin-1-ylsulfonylpyridin-4-yl)piperazine
MOLECULAR FORMULA: C16H26N4O2S
MOLECULAR WEIGHT: 338.46824
SMILES: CC(C)N1CCN(CC1)C2=C(C=NC=C2)S(=O)(=O)N3CCCC3
Structure:
CAS RN: 57725-28-7
CAS Name: 1-[3-(1-piperidinylsulfonyl)-4-pyridinyl]-4-propan-2-ylpiperazine
OPENEYE Name: 1-isopropyl-4-[3-(1-piperidylsulfonyl)-4-pyridyl]piperazine
IUPAC Name: 1-(3-piperidin-1-ylsulfonylpyridin-4-yl)-4-propan-2-ylpiperazine
SYSTEMATIC NAME: 1-(3-piperidin-1-ylsulfonylpyridin-4-yl)-4-propan-2-yl-piperazine
MOLECULAR FORMULA: C17H28N4O2S
MOLECULAR WEIGHT: 352.49482
SMILES: CC(C)N1CCN(CC1)C2=C(C=NC=C2)S(=O)(=O)N3CCCCC3
Structure:
CAS RN: 57725-37-8
CAS Name: 2-[4-[3-(1-pyrrolidinylsulfonyl)-4-pyridinyl]-1-piperazinyl]ethanol
OPENEYE Name: 2-[4-(3-pyrrolidin-1-ylsulfonyl-4-pyridyl)piperazin-1-yl]ethanol
IUPAC Name: 2-[4-(3-pyrrolidin-1-ylsulfonylpyridin-4-yl)piperazin-1-yl]ethanol
SYSTEMATIC NAME: 2-[4-(3-pyrrolidin-1-ylsulfonylpyridin-4-yl)piperazin-1-yl]ethanol
MOLECULAR FORMULA: C15H24N4O3S
MOLECULAR WEIGHT: 340.44106
SMILES: C1CCN(C1)S(=O)(=O)C2=C(C=CN=C2)N3CCN(CC3)CCO
Structure:
CAS RN: 57725-35-6
CAS Name: 2-[4-[3-(1-piperidinylsulfonyl)-4-pyridinyl]-1-piperazinyl]ethanol
OPENEYE Name: 2-[4-[3-(1-piperidylsulfonyl)-4-pyridyl]piperazin-1-yl]ethanol
IUPAC Name: 2-[4-(3-piperidin-1-ylsulfonylpyridin-4-yl)piperazin-1-yl]ethanol
SYSTEMATIC NAME: 2-[4-(3-piperidin-1-ylsulfonylpyridin-4-yl)piperazin-1-yl]ethanol
MOLECULAR FORMULA: C16H26N4O3S
MOLECULAR WEIGHT: 354.46764
SMILES: C1CCN(CC1)S(=O)(=O)C2=C(C=CN=C2)N3CCN(CC3)CCO
Structure:
CAS RN: 4671-12-9
CAS Name: 1,3,5-trimethylpurino[8,9-c][1,2,4]triazole-2,4-dione
OPENEYE Name: 1,3,5-trimethylpurino[8,9-c][1,2,4]triazole-2,4-dione
IUPAC Name: 1,3,5-trimethylpurino[8,9-c][1,2,4]triazole-2,4-dione
SYSTEMATIC NAME: 1,3,5-trimethylpurino[8,9-c][1,2,4]triazole-2,4-dione
MOLECULAR FORMULA: C9H10N6O2
MOLECULAR WEIGHT: 234.2147
SMILES: CN1C2=C(N(C(=O)N(C2=O)C)C)N3C1=NN=C3
Structure:
CAS RN: 53703-63-2
CAS Name: 8-hydrazinyl-1,3,7-trimethylpurine-2,6-dione
OPENEYE Name: 8-hydrazino-1,3,7-trimethyl-purine-2,6-dione
IUPAC Name: 8-hydrazinyl-1,3,7-trimethylpurine-2,6-dione
SYSTEMATIC NAME: 8-diazanyl-1,3,7-trimethyl-purine-2,6-dione
MOLECULAR FORMULA: C8H12N6O2
MOLECULAR WEIGHT: 224.21988
SMILES: CN1C2=C(N=C1NN)N(C(=O)N(C2=O)C)C
Structure:
CAS RN: 6156-52-1
CAS Name: 8-(1-hydroxybutan-2-ylamino)-1,3,7-trimethylpurine-2,6-dione
OPENEYE Name: 8-[1-(hydroxymethyl)propylamino]-1,3,7-trimethyl-purine-2,6-dione
IUPAC Name: 8-(1-hydroxybutan-2-ylamino)-1,3,7-trimethylpurine-2,6-dione
SYSTEMATIC NAME: 1,3,7-trimethyl-8-(1-oxidanylbutan-2-ylamino)purine-2,6-dione
MOLECULAR FORMULA: C12H19N5O3
MOLECULAR WEIGHT: 281.31096
SMILES: CCC(CO)NC1=NC2=C(N1C)C(=O)N(C(=O)N2C)C
Structure:
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