CAS RN: 67557-68-0
CAS Name: (2Z)-2-(3-oxo-1,4-dihydroquinoxalin-2-ylidene)propanenitrile
OPENEYE Name: (2Z)-2-(3-oxo-1,4-dihydroquinoxalin-2-ylidene)propanenitrile
IUPAC Name: (2Z)-2-(3-oxo-1,4-dihydroquinoxalin-2-ylidene)propanenitrile
SYSTEMATIC NAME: (2Z)-2-(3-oxidanylidene-1,4-dihydroquinoxalin-2-ylidene)propanenitrile
MOLECULAR FORMULA: C11H9N3O
MOLECULAR WEIGHT: 199.20866
SMILES: C/C(=C/1\C(=O)NC2=CC=CC=C2N1)/C#N
Structure:
CAS RN: 2461-62-3
CAS Name: (5E)-5-(hydroxymethylidene)-2-oxo-3-heptenedioic acid
OPENEYE Name: (5E)-5-(hydroxymethylene)-2-oxo-hept-3-enedioic acid
IUPAC Name: (5E)-5-(hydroxymethylidene)-2-oxohept-3-enedioic acid
SYSTEMATIC NAME: (5E)-2-oxidanylidene-5-(oxidanylmethylidene)hept-3-enedioic acid
MOLECULAR FORMULA: C8H8O6
MOLECULAR WEIGHT: 200.14552
SMILES: C(/C(=C\O)/C=CC(=O)C(=O)O)C(=O)O
Structure:
CAS RN: 6024-59-5
CAS Name: [(3,5-dimethoxy-4-oxo-1-cyclohexa-2,5-dienylidene)methylamino]urea
OPENEYE Name: [(3,5-dimethoxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)methylamino]urea
IUPAC Name: [(3,5-dimethoxy-4-oxocyclohexa-2,5-dien-1-ylidene)methylamino]urea
SYSTEMATIC NAME: 1-[(3,5-dimethoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]urea
MOLECULAR FORMULA: C10H13N3O4
MOLECULAR WEIGHT: 239.22792
SMILES: COC1=CC(=CNNC(=O)N)C=C(C1=O)OC
Structure:
CAS RN: 78338-23-5
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C28H34O12
MOLECULAR WEIGHT: 562.56236
SMILES: CC1=C(C(=O)C[C@]2([C@H]1C[C@@H]3[C@]45[C@@H]2[C@H]([C@@H](C([C@@H]4[C@H](C(=O)O3)OC(=O)/C=C(\C)/C6(CO6)C)(OC5)C(=O)OC)O)O)C)O
Structure:
CAS RN: 78338-24-6
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C28H36O12
MOLECULAR WEIGHT: 564.57824
SMILES: CC1=C(C(=O)C[C@]2([C@H]1C[C@@H]3[C@]45[C@@H]2[C@H]([C@@H](C([C@@H]4[C@H](C(=O)O3)OC(=O)/C=C(\C)/C(C)CO)(OC5)C(=O)OC)O)O)C)O
Structure:
CAS RN: 50935-71-2
CAS Name: (2S)-N-[(2E,4E,6S,7R)-7-[(2S,3S,4R,5R)-3,4-dihydroxy-5-[(1E,3E,5E)-7-(2-hydroxy-4-oxo-1H-pyridin-3-yl)-6-methyl-7-oxohepta-1,3,5-trienyl]-2-oxolanyl]-6-methoxy-5-methylocta-2,4-dienyl]-2-[(2R,3R,4R,6S)-2,3,4-trihydroxy-5,5-dimethyl-6-[(1E,3E)-penta-1,3-di
OPENEYE Name: (2S)-N-[(2E,4E,6S,7R)-7-[(2S,3S,4R,5R)-3,4-dihydroxy-5-[(1E,3E,5E)-7-(2-hydroxy-4-oxo-1H-pyridin-3-yl)-6-methyl-7-oxo-hepta-1,3,5-trienyl]tetrahydrofuran-2-yl]-6-methoxy-5-methyl-octa-2,4-dienyl]-2-[(2R,3R,4R,6S)-2,3,4-trihydroxy-5,5-dimethyl-6-[(1E,3E)-p
IUPAC Name: (2S)-N-[(2E,4E,6S,7R)-7-[(2S,3S,4R,5R)-3,4-dihydroxy-5-[(1E,3E,5E)-7-(2-hydroxy-4-oxo-1H-pyridin-3-yl)-6-methyl-7-oxohepta-1,3,5-trienyl]oxolan-2-yl]-6-methoxy-5-methylocta-2,4-dienyl]-2-[(2R,3R,4R,6S)-2,3,4-trihydroxy-5,5-dimethyl-6-[(1E,3E)-penta-1,3-di
SYSTEMATIC NAME: (2S)-2-[(2R,3R,4R,6S)-5,5-dimethyl-2,3,4-tris(oxidanyl)-6-[(1E,3E)-penta-1,3-dienyl]oxan-2-yl]-N-[(2E,4E,6S,7R)-6-methoxy-5-methyl-7-[(2S,3S,4R,5R)-5-[(1E,3E,5E)-6-methyl-7-oxidanylidene-7-(2-oxidanyl-4-oxidanylidene-1H-pyridin-3-yl)hepta-1,3,5-trienyl]-3
MOLECULAR FORMULA: C43H60N2O12
MOLECULAR WEIGHT: 796.9427
SMILES: CC[C@H](C(=O)NC/C=C/C=C(\C)/[C@H]([C@@H](C)[C@H]1[C@H]([C@H]([C@H](O1)/C=C/C=C/C=C(\C)/C(=O)C2=C(NC=CC2=O)O)O)O)OC)[C@@]3([C@@H]([C@@H](C([C@@H](O3)/C=C/C=C/C)(C)C)O)O)O
Structure:
CAS RN: 5232-63-3
CAS Name: 2-[1,2-bis(4-methoxyphenyl)butylamino]-N'-(3-indolylidenemethyl)acetohydrazide
OPENEYE Name: 2-[1,2-bis(4-methoxyphenyl)butylamino]-N'-(indol-3-ylidenemethyl)acetohydrazide
IUPAC Name: 2-[1,2-bis(4-methoxyphenyl)butylamino]-N'-(indol-3-ylidenemethyl)acetohydrazide
SYSTEMATIC NAME: 2-[1,2-bis(4-methoxyphenyl)butylamino]-N'-(indol-3-ylidenemethyl)ethanehydrazide
MOLECULAR FORMULA: C29H32N4O3
MOLECULAR WEIGHT: 484.58938
SMILES: CCC(C1=CC=C(C=C1)OC)C(C2=CC=C(C=C2)OC)NCC(=O)NNC=C3C=NC4=CC=CC=C43
Structure:
CAS RN: 77579-70-5
CAS Name: 2-[1,2-bis(4-methoxyphenyl)butylamino]-N'-(3-indolylidenemethyl)acetohydrazide
OPENEYE Name: 2-[1,2-bis(4-methoxyphenyl)butylamino]-N'-(indol-3-ylidenemethyl)acetohydrazide
IUPAC Name: 2-[1,2-bis(4-methoxyphenyl)butylamino]-N'-(indol-3-ylidenemethyl)acetohydrazide
SYSTEMATIC NAME: 2-[1,2-bis(4-methoxyphenyl)butylamino]-N'-(indol-3-ylidenemethyl)ethanehydrazide
MOLECULAR FORMULA: C29H32N4O3
MOLECULAR WEIGHT: 484.58938
SMILES: CCC(C1=CC=C(C=C1)OC)C(C2=CC=C(C=C2)OC)NCC(=O)NNC=C3C=NC4=CC=CC=C43
Structure:
CAS RN: 92736-20-4
CAS Name: 6-[2-[8-[[(6E)-6-(6-oxo-1-cyclohexa-2,4-dienylidene)-4-phenyl-1H-pyrimidin-2-yl]amino]octylamino]-4-phenyl-1H-pyrimidin-6-ylidene]-1-cyclohexa-2,4-dienone
OPENEYE Name: 6-[2-[8-[[(6E)-6-(6-oxocyclohexa-2,4-dien-1-ylidene)-4-phenyl-1H-pyrimidin-2-yl]amino]octylamino]-4-phenyl-1H-pyrimidin-6-ylidene]cyclohexa-2,4-dien-1-one
IUPAC Name: 6-[2-[8-[[(6E)-6-(6-oxocyclohexa-2,4-dien-1-ylidene)-4-phenyl-1H-pyrimidin-2-yl]amino]octylamino]-4-phenyl-1H-pyrimidin-6-ylidene]cyclohexa-2,4-dien-1-one
SYSTEMATIC NAME: 6-[2-[8-[[(6E)-6-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-4-phenyl-1H-pyrimidin-2-yl]amino]octylamino]-4-phenyl-1H-pyrimidin-6-ylidene]cyclohexa-2,4-dien-1-one
MOLECULAR FORMULA: C40H40N6O2
MOLECULAR WEIGHT: 636.7846
SMILES: C1=CC=C(C=C1)C2=CC(=C3C=CC=CC3=O)NC(=N2)NCCCCCCCCNC4=NC(=C/C(=C\5/C=CC=CC5=O)/N4)C6=CC=CC=C6
Structure:
CAS RN: 92736-16-8
CAS Name: 6-[5-methyl-2-[8-[[(6E)-5-methyl-6-(6-oxo-1-cyclohexa-2,4-dienylidene)-1H-pyrimidin-2-yl]amino]octylamino]-1H-pyrimidin-6-ylidene]-1-cyclohexa-2,4-dienone
OPENEYE Name: 6-[5-methyl-2-[8-[[(6E)-5-methyl-6-(6-oxocyclohexa-2,4-dien-1-ylidene)-1H-pyrimidin-2-yl]amino]octylamino]-1H-pyrimidin-6-ylidene]cyclohexa-2,4-dien-1-one
IUPAC Name: 6-[5-methyl-2-[8-[[(6E)-5-methyl-6-(6-oxocyclohexa-2,4-dien-1-ylidene)-1H-pyrimidin-2-yl]amino]octylamino]-1H-pyrimidin-6-ylidene]cyclohexa-2,4-dien-1-one
SYSTEMATIC NAME: 6-[5-methyl-2-[8-[[(6E)-5-methyl-6-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-1H-pyrimidin-2-yl]amino]octylamino]-1H-pyrimidin-6-ylidene]cyclohexa-2,4-dien-1-one
MOLECULAR FORMULA: C30H36N6O2
MOLECULAR WEIGHT: 512.64584
SMILES: CC1=CN=C(NC1=C2C=CC=CC2=O)NCCCCCCCCNC3=NC=C(/C(=C\4/C=CC=CC4=O)/N3)C
Structure:
CAS RN: 78797-09-8
CAS Name: 6-(nitrosomethylidene)-1H-pyridine-2-carbothioamide
OPENEYE Name: 6-(nitrosomethylene)-1H-pyridine-2-carbothioamide
IUPAC Name: 6-(nitrosomethylidene)-1H-pyridine-2-carbothioamide
SYSTEMATIC NAME: 6-(nitrosomethylidene)-1H-pyridine-2-carbothioamide
MOLECULAR FORMULA: C7H7N3OS
MOLECULAR WEIGHT: 181.21498
SMILES: C1=CC(=CN=O)NC(=C1)C(=S)N
Structure:
CAS RN: 67643-23-6
CAS Name: (3Z)-3-[hydroxy(methoxy)methylidene]-6-nitroisoquinoline-1,4-dione
OPENEYE Name: (3Z)-3-[hydroxy(methoxy)methylene]-6-nitro-isoquinoline-1,4-dione
IUPAC Name: (3Z)-3-[hydroxy(methoxy)methylidene]-6-nitroisoquinoline-1,4-dione
SYSTEMATIC NAME: (3Z)-3-[methoxy(oxidanyl)methylidene]-6-nitro-isoquinoline-1,4-dione
MOLECULAR FORMULA: C11H8N2O6
MOLECULAR WEIGHT: 264.19102
SMILES: CO/C(=C\1/C(=O)C2=C(C=CC(=C2)[N+](=O)[O-])C(=O)N1)/O
Structure:
CAS RN: 66172-15-4
CAS Name: (2E)-2-[[2-(1,1,1,3,3,3-hexafluoropropan-2-yl)-4-(1,1,1,3,3,3-hexafluoropropan-2-ylidene)-1,3-dithietan-2-yl]-[4-(1,1,1,3,3,3-hexafluoropropan-2-ylidene)-2-methyl-1,3-dithietan-2-yl]methylidene]-7-(1,1,1,3,3,3-hexafluoropropan-2-ylidene)-5-methyl-3,4,6-tr
OPENEYE Name: (2E)-5-methyl-2-[[2-methyl-4-[2,2,2-trifluoro-1-(trifluoromethyl)ethylidene]-1,3-dithietan-2-yl]-[2-[2,2,2-trifluoro-1-(trifluoromethyl)ethyl]-4-[2,2,2-trifluoro-1-(trifluoromethyl)ethylidene]-1,3-dithietan-2-yl]methylene]-7-[2,2,2-trifluoro-1-(trifluorom
IUPAC Name: (2E)-2-[[2-(1,1,1,3,3,3-hexafluoropropan-2-yl)-4-(1,1,1,3,3,3-hexafluoropropan-2-ylidene)-1,3-dithietan-2-yl]-[4-(1,1,1,3,3,3-hexafluoropropan-2-ylidene)-2-methyl-1,3-dithietan-2-yl]methylidene]-7-(1,1,1,3,3,3-hexafluoropropan-2-ylidene)-5-methyl-3,4,6-tr
SYSTEMATIC NAME: (2E)-2-[[2-[1,1,1,3,3,3-hexakis(fluoranyl)propan-2-yl]-4-[1,1,1,3,3,3-hexakis(fluoranyl)propan-2-ylidene]-1,3-dithietan-2-yl]-[4-[1,1,1,3,3,3-hexakis(fluoranyl)propan-2-ylidene]-2-methyl-1,3-dithietan-2-yl]methylidene]-7-[1,1,1,3,3,3-hexakis(fluoranyl)pro
MOLECULAR FORMULA: C23H8F24S7
MOLECULAR WEIGHT: 964.726297
SMILES: CC12C(/C(=C(/C3(SC(=C(C(F)(F)F)C(F)(F)F)S3)C)\C4(SC(=C(C(F)(F)F)C(F)(F)F)S4)C(C(F)(F)F)C(F)(F)F)/SS1)C(=C(C(F)(F)F)C(F)(F)F)S2
Structure:
CAS RN: 33739-30-9
CAS Name: (2E)-2-[(N-methylanilino)methylidene]-1-cyclohexanone
OPENEYE Name: (2E)-2-[(N-methylanilino)methylene]cyclohexanone
IUPAC Name: (2E)-2-[(N-methylanilino)methylidene]cyclohexan-1-one
SYSTEMATIC NAME: (2E)-2-[[methyl(phenyl)amino]methylidene]cyclohexan-1-one
MOLECULAR FORMULA: C14H17NO
MOLECULAR WEIGHT: 215.29088
SMILES: CN(/C=C/1\CCCCC1=O)C2=CC=CC=C2
Structure:
CAS RN: 76881-18-0
CAS Name: (6E)-3-ethoxy-6-(trimethylsilyloxymethylidene)-1-cyclohex-2-enone
OPENEYE Name: (6E)-3-ethoxy-6-(trimethylsilyloxymethylene)cyclohex-2-en-1-one
IUPAC Name: (6E)-3-ethoxy-6-(trimethylsilyloxymethylidene)cyclohex-2-en-1-one
SYSTEMATIC NAME: (6E)-3-ethoxy-6-(trimethylsilyloxymethylidene)cyclohex-2-en-1-one
MOLECULAR FORMULA: C12H20O3Si
MOLECULAR WEIGHT: 240.3709
SMILES: CCOC1=CC(=O)/C(=C/O[Si](C)(C)C)/CC1
Structure:
CAS RN: 73355-55-2
CAS Name: [(2-chloro-7-hydroxy-6-methyl-4,5-dioxo-3-indolylidene)methylamino]thiourea
OPENEYE Name: [(2-chloro-7-hydroxy-6-methyl-4,5-dioxo-indol-3-ylidene)methylamino]thiourea
IUPAC Name: [(2-chloro-7-hydroxy-6-methyl-4,5-dioxoindol-3-ylidene)methylamino]thiourea
SYSTEMATIC NAME: 1-[[2-chloranyl-6-methyl-7-oxidanyl-4,5-bis(oxidanylidene)indol-3-ylidene]methylamino]thiourea
MOLECULAR FORMULA: C11H9ClN4O3S
MOLECULAR WEIGHT: 312.73216
SMILES: CC1=C(C2=C(C(=CNNC(=S)N)C(=N2)Cl)C(=O)C1=O)O
Structure:
CAS RN: 73355-53-0
CAS Name: [(2-chloro-6-methyl-4,5-dioxo-3-indolylidene)methylamino]thiourea
OPENEYE Name: [(2-chloro-6-methyl-4,5-dioxo-indol-3-ylidene)methylamino]thiourea
IUPAC Name: [(2-chloro-6-methyl-4,5-dioxoindol-3-ylidene)methylamino]thiourea
SYSTEMATIC NAME: 1-[[2-chloranyl-6-methyl-4,5-bis(oxidanylidene)indol-3-ylidene]methylamino]thiourea
MOLECULAR FORMULA: C11H9ClN4O2S
MOLECULAR WEIGHT: 296.73276
SMILES: CC1=CC2=C(C(=CNNC(=S)N)C(=N2)Cl)C(=O)C1=O
Structure:
CAS RN: 61759-54-4
CAS Name: N-[(1E,3E)-penta-1,3-dienyl]carbamic acid phenyl ester
OPENEYE Name: phenyl N-[(1E,3E)-penta-1,3-dienyl]carbamate
IUPAC Name: phenyl N-[(1E,3E)-penta-1,3-dienyl]carbamate
SYSTEMATIC NAME: phenyl N-[(1E,3E)-penta-1,3-dienyl]carbamate
MOLECULAR FORMULA: C12H13NO2
MOLECULAR WEIGHT: 203.23712
SMILES: C/C=C/C=C/NC(=O)OC1=CC=CC=C1
Structure:
CAS RN: 61759-58-8
CAS Name: N-[(1E)-buta-1,3-dienyl]carbamothioic acid S-phenyl ester
OPENEYE Name: S-phenyl N-[(1E)-buta-1,3-dienyl]carbamothioate
IUPAC Name: S-phenyl N-[(1E)-buta-1,3-dienyl]carbamothioate
SYSTEMATIC NAME: S-phenyl N-[(1E)-buta-1,3-dienyl]carbamothioate
MOLECULAR FORMULA: C11H11NOS
MOLECULAR WEIGHT: 205.27614
SMILES: C=C/C=C/NC(=O)SC1=CC=CC=C1
Structure:
CAS RN: 65899-49-2
CAS Name: N-[(1E)-buta-1,3-dienyl]carbamic acid (phenylmethyl) ester
OPENEYE Name: benzyl N-[(1E)-buta-1,3-dienyl]carbamate
IUPAC Name: benzyl N-[(1E)-buta-1,3-dienyl]carbamate
SYSTEMATIC NAME: (phenylmethyl) N-[(1E)-buta-1,3-dienyl]carbamate
MOLECULAR FORMULA: C12H13NO2
MOLECULAR WEIGHT: 203.23712
SMILES: C=C/C=C/NC(=O)OCC1=CC=CC=C1
Structure:
CAS RN: 67886-57-1
CAS Name: (Z)-1-(1-adamantyl)-2-(benzenesulfonyl)ethenamine
OPENEYE Name: (Z)-1-(1-adamantyl)-2-(benzenesulfonyl)ethenamine
IUPAC Name: (Z)-1-(1-adamantyl)-2-(benzenesulfonyl)ethenamine
SYSTEMATIC NAME: (Z)-1-(1-adamantyl)-2-(phenylsulfonyl)ethenamine
MOLECULAR FORMULA: C18H23NO2S
MOLECULAR WEIGHT: 317.44572
SMILES: C1C2CC3CC1CC(C2)(C3)/C(=C/S(=O)(=O)C4=CC=CC=C4)/N
Structure:
CAS RN: 69962-81-8
CAS Name: (2E,4E)-2-[(1R)-1-hydroxy-2-oxopropyl]hexa-2,4-dienal
OPENEYE Name: (2E,4E)-2-[(1R)-1-hydroxy-2-oxo-propyl]hexa-2,4-dienal
IUPAC Name: (2E,4E)-2-[(1R)-1-hydroxy-2-oxopropyl]hexa-2,4-dienal
SYSTEMATIC NAME: (2E,4E)-2-[(1R)-1-oxidanyl-2-oxidanylidene-propyl]hexa-2,4-dienal
MOLECULAR FORMULA: C9H12O3
MOLECULAR WEIGHT: 168.18978
SMILES: C/C=C/C=C(/C=O)\[C@H](C(=O)C)O
Structure:
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