CAS RN: 103899-97-4
CAS Name: 1-[(3R,6S)-6-methyl-3-(2-methylphenyl)-5-sulfanylidene-1,2,4-oxadiazinan-2-yl]ethanone
OPENEYE Name: 1-[(3R,6S)-6-methyl-3-(o-tolyl)-5-thioxo-1,2,4-oxadiazinan-2-yl]ethanone
IUPAC Name: 1-[(3R,6S)-6-methyl-3-(2-methylphenyl)-5-sulfanylidene-1,2,4-oxadiazinan-2-yl]ethanone
SYSTEMATIC NAME: 1-[(3R,6S)-6-methyl-3-(2-methylphenyl)-5-sulfanylidene-1,2,4-oxadiazinan-2-yl]ethanone
MOLECULAR FORMULA: C13H16N2O2S
MOLECULAR WEIGHT: 264.34334
SMILES: C[C@H]1C(=S)N[C@H](N(O1)C(=O)C)C2=CC=CC=C2C
Structure:
CAS RN: 103900-02-3
CAS Name: 1-[(3R,6S)-6-ethyl-3-phenyl-5-sulfanylidene-1,2,4-oxadiazinan-2-yl]ethanone
OPENEYE Name: 1-[(3R,6S)-6-ethyl-3-phenyl-5-thioxo-1,2,4-oxadiazinan-2-yl]ethanone
IUPAC Name: 1-[(3R,6S)-6-ethyl-3-phenyl-5-sulfanylidene-1,2,4-oxadiazinan-2-yl]ethanone
SYSTEMATIC NAME: 1-[(3R,6S)-6-ethyl-3-phenyl-5-sulfanylidene-1,2,4-oxadiazinan-2-yl]ethanone
MOLECULAR FORMULA: C13H16N2O2S
MOLECULAR WEIGHT: 264.34334
SMILES: CC[C@H]1C(=S)N[C@H](N(O1)C(=O)C)C2=CC=CC=C2
Structure:
CAS RN: 103900-06-7
CAS Name: 1-[(3R,6S)-3-[4-(dimethylamino)phenyl]-6-methyl-5-sulfanylidene-1,2,4-oxadiazinan-2-yl]ethanone
OPENEYE Name: 1-[(3R,6S)-3-[4-(dimethylamino)phenyl]-6-methyl-5-thioxo-1,2,4-oxadiazinan-2-yl]ethanone
IUPAC Name: 1-[(3R,6S)-3-[4-(dimethylamino)phenyl]-6-methyl-5-sulfanylidene-1,2,4-oxadiazinan-2-yl]ethanone
SYSTEMATIC NAME: 1-[(3R,6S)-3-[4-(dimethylamino)phenyl]-6-methyl-5-sulfanylidene-1,2,4-oxadiazinan-2-yl]ethanone
MOLECULAR FORMULA: C14H19N3O2S
MOLECULAR WEIGHT: 293.38456
SMILES: C[C@H]1C(=S)N[C@H](N(O1)C(=O)C)C2=CC=C(C=C2)N(C)C
Structure:
CAS RN: 102504-24-5
CAS Name: 8-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-1,2-dimethyl-4-oxa-2,8-diazaspiro[4.5]decan-3-one
OPENEYE Name: 8-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-1,2-dimethyl-4-oxa-2,8-diazaspiro[4.5]decan-3-one
IUPAC Name: 8-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-1,2-dimethyl-4-oxa-2,8-diazaspiro[4.5]decan-3-one
SYSTEMATIC NAME: 8-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-1,2-dimethyl-4-oxa-2,8-diazaspiro[4.5]decan-3-one
MOLECULAR FORMULA: C18H24N2O4
MOLECULAR WEIGHT: 332.39416
SMILES: CC1C2(CCN(CC2)CC3COC4=CC=CC=C4O3)OC(=O)N1C
Structure:
CAS RN: 10476-73-0
CAS Name: 4-tert-butyl-7-oxabicyclo[4.1.0]hept-3-ene-2,5-dione
OPENEYE Name: 4-tert-butyl-7-oxabicyclo[4.1.0]hept-3-ene-2,5-dione
IUPAC Name: 4-tert-butyl-7-oxabicyclo[4.1.0]hept-3-ene-2,5-dione
SYSTEMATIC NAME: 4-tert-butyl-7-oxabicyclo[4.1.0]hept-3-ene-2,5-dione
MOLECULAR FORMULA: C10H12O3
MOLECULAR WEIGHT: 180.20048
SMILES: CC(C)(C)C1=CC(=O)C2C(C1=O)O2
Structure:
CAS RN: 102504-23-4
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C16H16BrNO3
MOLECULAR WEIGHT: 350.20714
SMILES: C1CC2C3C(C1O2)C(=O)N(C3=O)CC4=CC(=CC=C4)CBr
Structure:
CAS RN: 102504-22-3
CAS Name: 8-[4-(4-fluorophenyl)-4-oxobutyl]-2-propyl-3-oxa-8-azaspiro[4.5]decan-4-one hydrochloride
OPENEYE Name: 8-[4-(4-fluorophenyl)-4-oxo-butyl]-2-propyl-3-oxa-8-azaspiro[4.5]decan-4-one hydrochloride
IUPAC Name: 8-[4-(4-fluorophenyl)-4-oxobutyl]-2-propyl-3-oxa-8-azaspiro[4.5]decan-4-one hydrochloride
SYSTEMATIC NAME: 8-[4-(4-fluorophenyl)-4-oxidanylidene-butyl]-2-propyl-3-oxa-8-azaspiro[4.5]decan-4-one hydrochloride
MOLECULAR FORMULA: C21H29ClFNO3
MOLECULAR WEIGHT: 397.911263
SMILES: CCCC1CC2(CCN(CC2)CCCC(=O)C3=CC=C(C=C3)F)C(=O)O1.Cl
Structure:
CAS RN: 91240-34-5
CAS Name: 9-methyl-7-oxa-9-azaspiro[4.5]decane-8,10-dione
OPENEYE Name: 9-methyl-7-oxa-9-azaspiro[4.5]decane-8,10-dione
IUPAC Name: 9-methyl-7-oxa-9-azaspiro[4.5]decane-8,10-dione
SYSTEMATIC NAME: 9-methyl-7-oxa-9-azaspiro[4.5]decane-8,10-dione
MOLECULAR FORMULA: C9H13NO3
MOLECULAR WEIGHT: 183.20442
SMILES: CN1C(=O)C2(CCCC2)COC1=O
Structure:
CAS RN: 94997-26-9
CAS Name: 7-methyl-9-phenyl-3-prop-2-enyl-8-oxa-3-azaspiro[4.5]decane-2,4-dione
OPENEYE Name: 3-allyl-7-methyl-9-phenyl-8-oxa-3-azaspiro[4.5]decane-2,4-dione
IUPAC Name: 7-methyl-9-phenyl-3-prop-2-enyl-8-oxa-3-azaspiro[4.5]decane-2,4-dione
SYSTEMATIC NAME: 7-methyl-9-phenyl-3-prop-2-enyl-8-oxa-3-azaspiro[4.5]decane-2,4-dione
MOLECULAR FORMULA: C18H21NO3
MOLECULAR WEIGHT: 299.36424
SMILES: CC1CC2(CC(O1)C3=CC=CC=C3)CC(=O)N(C2=O)CC=C
Structure:
CAS RN: 102504-19-8
CAS Name: (2S,3S)-2,3-dihydroxy-4-[2-[(9-methyl-3-oxa-9-azabicyclo[3.3.1]nonan-7-yl)oxy]-2-oxo-1,1-diphenylethoxy]-4-oxobutanoic acid
OPENEYE Name: (2S,3S)-2,3-dihydroxy-4-[2-[(9-methyl-3-oxa-9-azabicyclo[3.3.1]nonan-7-yl)oxy]-2-oxo-1,1-diphenyl-ethoxy]-4-oxo-butanoic acid
IUPAC Name: (2S,3S)-2,3-dihydroxy-4-[2-[(9-methyl-3-oxa-9-azabicyclo[3.3.1]nonan-7-yl)oxy]-2-oxo-1,1-diphenylethoxy]-4-oxobutanoic acid
SYSTEMATIC NAME: (2S,3S)-4-[2-[(9-methyl-3-oxa-9-azabicyclo[3.3.1]nonan-7-yl)oxy]-2-oxidanylidene-1,1-diphenyl-ethoxy]-2,3-bis(oxidanyl)-4-oxidanylidene-butanoic acid
MOLECULAR FORMULA: C26H29NO9
MOLECULAR WEIGHT: 499.50976
SMILES: CN1C2CC(CC1COC2)OC(=O)C(C3=CC=CC=C3)(C4=CC=CC=C4)OC(=O)[C@H]([C@@H](C(=O)O)O)O
Structure:
CAS RN: 95548-14-4
CAS Name: (Z)-N-[(4-hydroxy-3-methoxyphenyl)methyl]-11-octadecenamide
OPENEYE Name: (Z)-N-[(4-hydroxy-3-methoxy-phenyl)methyl]octadec-11-enamide
IUPAC Name: (Z)-N-[(4-hydroxy-3-methoxyphenyl)methyl]octadec-11-enamide
SYSTEMATIC NAME: (Z)-N-[(3-methoxy-4-oxidanyl-phenyl)methyl]octadec-11-enamide
MOLECULAR FORMULA: C26H43NO3
MOLECULAR WEIGHT: 417.62452
SMILES: CCCCCC/C=C\CCCCCCCCCC(=O)NCC1=CC(=C(C=C1)O)OC
Structure:
CAS RN: 95548-13-3
CAS Name: (Z)-N-[(4-hydroxy-3-methoxyphenyl)methyl]-6-octadecenamide
OPENEYE Name: (Z)-N-[(4-hydroxy-3-methoxy-phenyl)methyl]octadec-6-enamide
IUPAC Name: (Z)-N-[(4-hydroxy-3-methoxyphenyl)methyl]octadec-6-enamide
SYSTEMATIC NAME: (Z)-N-[(3-methoxy-4-oxidanyl-phenyl)methyl]octadec-6-enamide
MOLECULAR FORMULA: C26H43NO3
MOLECULAR WEIGHT: 417.62452
SMILES: CCCCCCCCCCC/C=C\CCCCC(=O)NCC1=CC(=C(C=C1)O)OC
Structure:
CAS RN: 95548-24-6
CAS Name: (Z)-N-[(4-hydroxy-3-methoxyphenyl)methyl]-6-octadecenamide
OPENEYE Name: (Z)-N-[(4-hydroxy-3-methoxy-phenyl)methyl]octadec-6-enamide
IUPAC Name: (Z)-N-[(4-hydroxy-3-methoxyphenyl)methyl]octadec-6-enamide
SYSTEMATIC NAME: (Z)-N-[(3-methoxy-4-oxidanyl-phenyl)methyl]octadec-6-enamide
MOLECULAR FORMULA: C26H43NO3
MOLECULAR WEIGHT: 417.62452
SMILES: CCCCCCCCCCC/C=C\CCCCC(=O)NCC1=CC(=C(C=C1)O)OC
Structure:
CAS RN: 95548-11-1
CAS Name: (Z)-N-[(4-hydroxy-3-methoxyphenyl)methyl]-10-nonadecenamide
OPENEYE Name: (Z)-N-[(4-hydroxy-3-methoxy-phenyl)methyl]nonadec-10-enamide
IUPAC Name: (Z)-N-[(4-hydroxy-3-methoxyphenyl)methyl]nonadec-10-enamide
SYSTEMATIC NAME: (Z)-N-[(3-methoxy-4-oxidanyl-phenyl)methyl]nonadec-10-enamide
MOLECULAR FORMULA: C27H45NO3
MOLECULAR WEIGHT: 431.6511
SMILES: CCCCCCCC/C=C\CCCCCCCCC(=O)NCC1=CC(=C(C=C1)O)OC
Structure:
CAS RN: 102280-54-6
CAS Name: N-(1,2,3,4-tetrahydronaphthalen-2-yl)-4,5-dihydrooxazol-2-amine
OPENEYE Name: N-tetralin-2-yl-4,5-dihydrooxazol-2-amine
IUPAC Name: N-(1,2,3,4-tetrahydronaphthalen-2-yl)-4,5-dihydro-1,3-oxazol-2-amine
SYSTEMATIC NAME: N-(1,2,3,4-tetrahydronaphthalen-2-yl)-4,5-dihydro-1,3-oxazol-2-amine
MOLECULAR FORMULA: C13H16N2O
MOLECULAR WEIGHT: 216.27894
SMILES: C1CC2=CC=CC=C2CC1NC3=NCCO3
Structure:
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