CAS RN: 68266-19-3
CAS Name: (3Z)-3-[mercapto-(4-methylanilino)methylidene]-3,4-dihydro-2H-1-benzopyran-2,4-dione
OPENEYE Name: (3Z)-3-[(4-methylanilino)-sulfanyl-methylene]chromane-2,4-dione
IUPAC Name: (3Z)-3-[(4-methylanilino)-sulfanylmethylidene]chromene-2,4-dione
SYSTEMATIC NAME: (3Z)-3-[[(4-methylphenyl)amino]-sulfanyl-methylidene]chromene-2,4-dione
MOLECULAR FORMULA: C17H13NO3S
MOLECULAR WEIGHT: 311.35502
SMILES: CC1=CC=C(C=C1)N/C(=C/2\C(=O)C3=CC=CC=C3OC2=O)/S
Structure:
CAS RN: 62446-14-4
CAS Name: (5R,8R,9S,10S,13R,14S,17R)-17-[(2R,5R)-5-ethyl-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene
OPENEYE Name: (5R,8R,9S,10S,13R,14S,17R)-17-[(1R,4R)-4-ethyl-1,5-dimethyl-hexyl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene
IUPAC Name: (5R,8R,9S,10S,13R,14S,17R)-17-[(2R,5R)-5-ethyl-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene
SYSTEMATIC NAME: (5R,8R,9S,10S,13R,14S,17R)-17-[(2R,5R)-5-ethyl-6-methyl-heptan-2-yl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene
MOLECULAR FORMULA: C29H52
MOLECULAR WEIGHT: 400.72318
SMILES: CC[C@H](CC[C@@H](C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@@H]4[C@@]3(CCCC4)C)C)C(C)C
Structure:
CAS RN: 58821-99-1
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C30H34O7
MOLECULAR WEIGHT: 506.58676
SMILES: C[C@H]1C[C@@]2([C@@H]3[C@@H]4C1([C@H]5C=C(C(=O)[C@@]5(CC(=C4)COC(=O)C)O)C)O[C@](O3)(O2)CC6=CC=CC=C6)C(=C)C
Structure:
CAS RN: 87865-68-7
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C30H34O7
MOLECULAR WEIGHT: 506.58676
SMILES: C[C@H]1C[C@@]2([C@@H]3[C@@H]4C1([C@H]5C=C(C(=O)[C@@]5(CC(=C4)COC(=O)C)O)C)O[C@](O3)(O2)CC6=CC=CC=C6)C(=C)C
Structure:
CAS RN: 58775-51-2
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C18H12O7
MOLECULAR WEIGHT: 340.28368
SMILES: COC1=C2C(=CC3=C1[C@@]4(C=CO[C@@H]4O3)O)OC5=C(C2=O)C(=CC=C5)O
Structure:
CAS RN: 33558-05-3
CAS Name: (2S)-2-[[anilino(oxo)methyl]-nitrosoamino]propanoic acid
OPENEYE Name: (2S)-2-[nitroso(phenylcarbamoyl)amino]propanoic acid
IUPAC Name: (2S)-2-[nitroso(phenylcarbamoyl)amino]propanoic acid
SYSTEMATIC NAME: (2S)-2-[nitroso(phenylcarbamoyl)amino]propanoic acid
MOLECULAR FORMULA: C10H11N3O4
MOLECULAR WEIGHT: 237.21204
SMILES: C[C@@H](C(=O)O)N(C(=O)NC1=CC=CC=C1)N=O
Structure:
CAS RN: 39928-26-2
CAS Name: (2S)-2-[[anilino(oxo)methyl]-nitrosoamino]propanoic acid
OPENEYE Name: (2S)-2-[nitroso(phenylcarbamoyl)amino]propanoic acid
IUPAC Name: (2S)-2-[nitroso(phenylcarbamoyl)amino]propanoic acid
SYSTEMATIC NAME: (2S)-2-[nitroso(phenylcarbamoyl)amino]propanoic acid
MOLECULAR FORMULA: C10H11N3O4
MOLECULAR WEIGHT: 237.21204
SMILES: C[C@@H](C(=O)O)N(C(=O)NC1=CC=CC=C1)N=O
Structure:
CAS RN: 148708-26-3
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C19H23NO5
MOLECULAR WEIGHT: 345.38962
SMILES: COCCN1CC[C@]23[C@@H]4C(=O)CC[C@]2([C@H]1CC5=C3C(=C(C=C5)O)O4)O
Structure:
CAS RN: 88939-40-6
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C19H23NO5
MOLECULAR WEIGHT: 345.38962
SMILES: COCCN1CC[C@]23[C@@H]4C(=O)CC[C@]2([C@H]1CC5=C3C(=C(C=C5)O)O4)O
Structure:
CAS RN: 50299-98-4
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C21H31NO
MOLECULAR WEIGHT: 313.47694
SMILES: CC(C)(C)OC1=CC2=C(C[C@@H]3[C@H]4[C@@]2(CCCC4)CCN3C)C=C1
Structure:
CAS RN: 70021-29-3
CAS Name: 2-amino-N-[(2S)-2-[[2-[[(2R)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)-1-oxopropyl]amino]-1-oxopropyl]amino]-1-oxoethyl]amino]-1-oxo-3-phenylpropyl]-4-methylsulfinylbutanamide
OPENEYE Name: 2-amino-N-[(2S)-2-[[2-[[(2R)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]propanoyl]amino]acetyl]amino]-3-phenyl-propanoyl]-4-methylsulfinyl-butanamide
IUPAC Name: 2-amino-N-[(2S)-2-[[2-[[(2R)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]propanoyl]amino]acetyl]amino]-3-phenylpropanoyl]-4-methylsulfinylbutanamide
SYSTEMATIC NAME: 2-azanyl-N-[(2S)-2-[2-[[(2R)-2-[[(2S)-2-azanyl-3-(4-hydroxyphenyl)propanoyl]amino]propanoyl]amino]ethanoylamino]-3-phenyl-propanoyl]-4-methylsulfinyl-butanamide
MOLECULAR FORMULA: C28H38N6O7S
MOLECULAR WEIGHT: 602.70232
SMILES: C[C@H](C(=O)NCC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NC(=O)C(CCS(=O)C)N)NC(=O)[C@H](CC2=CC=C(C=C2)O)N
Structure:
CAS RN: 72785-20-7
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C18H21NO4
MOLECULAR WEIGHT: 315.36364
SMILES: CN1CC[C@]23[C@@H]4[C@H]1CC5=C2C(=C(C=C5)OC)O[C@@H]3[C@H]([C@@H]6[C@H]4O6)O
Structure:
CAS RN: 77632-94-1
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C17H19NO4
MOLECULAR WEIGHT: 301.33706
SMILES: CN1CC[C@]23[C@@H]4[C@H]1CC5=C2C(=C(C=C5)O)O[C@@H]3[C@H]([C@@H]6[C@H]4O6)O
Structure:
CAS RN: 77632-95-2
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C21H23NO6
MOLECULAR WEIGHT: 385.41042
SMILES: CC(=O)O[C@H]1[C@@H]2[C@@H](O2)[C@H]3[C@H]4CC5=C6[C@]3([C@@H]1OC6=C(C=C5)OC(=O)C)CCN4C
Structure:
CAS RN: 85619-68-7
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C22H29NO
MOLECULAR WEIGHT: 323.47176
SMILES: CC(=O)C1=CC2=C(C[C@@H]3[C@H]4[C@@]2(CCCC4)CCN3CC5CC5)C=C1
Structure:
CAS RN: 118194-49-3
CAS Name: (2S)-2-amino-N-[(2R)-1-[[(2S)-1-[[(2S)-2-[[(2R)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)-1-oxopropyl]amino]-1-oxopropyl]amino]-1-oxo-3-phenylpropyl]hydrazo]-1-oxo-3-phenylpropan-2-yl]amino]-1-oxopropan-2-yl]-3-(4-hydroxyphenyl)propanamide
OPENEYE Name: (2S)-2-amino-N-[(1R)-2-[[(1S)-2-[2-[(2S)-2-[[(2R)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]propanoyl]amino]-3-phenyl-propanoyl]hydrazino]-1-benzyl-2-oxo-ethyl]amino]-1-methyl-2-oxo-ethyl]-3-(4-hydroxyphenyl)propanamide
IUPAC Name: (2S)-2-amino-N-[(2R)-1-[[(2S)-1-[2-[(2S)-2-[[(2R)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]propanoyl]amino]-3-phenylpropanoyl]hydrazinyl]-1-oxo-3-phenylpropan-2-yl]amino]-1-oxopropan-2-yl]-3-(4-hydroxyphenyl)propanamide
SYSTEMATIC NAME: (2S)-2-azanyl-N-[(2R)-1-[[(2S)-1-[2-[(2S)-2-[[(2R)-2-[[(2S)-2-azanyl-3-(4-hydroxyphenyl)propanoyl]amino]propanoyl]amino]-3-phenyl-propanoyl]hydrazinyl]-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-1-oxidanylidene-propan-2-yl]-3-(4-hydroxyphenyl)propanamide
MOLECULAR FORMULA: C42H50N8O8
MOLECULAR WEIGHT: 794.8952
SMILES: C[C@H](C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NNC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H](C)NC(=O)[C@H](CC3=CC=C(C=C3)O)N)NC(=O)[C@H](CC4=CC=C(C=C4)O)N
Structure:
CAS RN: 88191-63-3
CAS Name: (2S)-2-amino-N-[(2R)-1-[[(2S)-1-[[(2S)-2-[[(2R)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)-1-oxopropyl]amino]-1-oxopropyl]amino]-1-oxo-3-phenylpropyl]hydrazo]-1-oxo-3-phenylpropan-2-yl]amino]-1-oxopropan-2-yl]-3-(4-hydroxyphenyl)propanamide
OPENEYE Name: (2S)-2-amino-N-[(1R)-2-[[(1S)-2-[2-[(2S)-2-[[(2R)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]propanoyl]amino]-3-phenyl-propanoyl]hydrazino]-1-benzyl-2-oxo-ethyl]amino]-1-methyl-2-oxo-ethyl]-3-(4-hydroxyphenyl)propanamide
IUPAC Name: (2S)-2-amino-N-[(2R)-1-[[(2S)-1-[2-[(2S)-2-[[(2R)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]propanoyl]amino]-3-phenylpropanoyl]hydrazinyl]-1-oxo-3-phenylpropan-2-yl]amino]-1-oxopropan-2-yl]-3-(4-hydroxyphenyl)propanamide
SYSTEMATIC NAME: (2S)-2-azanyl-N-[(2R)-1-[[(2S)-1-[2-[(2S)-2-[[(2R)-2-[[(2S)-2-azanyl-3-(4-hydroxyphenyl)propanoyl]amino]propanoyl]amino]-3-phenyl-propanoyl]hydrazinyl]-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-1-oxidanylidene-propan-2-yl]-3-(4-hydroxyphenyl)propanamide
MOLECULAR FORMULA: C42H50N8O8
MOLECULAR WEIGHT: 794.8952
SMILES: C[C@H](C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NNC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H](C)NC(=O)[C@H](CC3=CC=C(C=C3)O)N)NC(=O)[C@H](CC4=CC=C(C=C4)O)N
Structure:
CAS RN: 124532-14-5
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C23H22N2O3
MOLECULAR WEIGHT: 374.43238
SMILES: CN1CC[C@]23[C@@H]4C5=C(C[C@]2([C@H]1CC6=C3C(=C(C=C6)O)O4)O)C7=CC=CC=C7N5
Structure:
CAS RN: 132930-82-6
CAS Name: (2S)-2-[[(2S)-2-[[(2S)-2-[[2-[[(2R)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)-1-oxopropyl]amino]-1-oxopropyl]amino]-1-oxoethyl]amino]-1-oxo-3-phenylpropyl]amino]-4-methyl-1-oxopentyl]amino]-3-hydroxypropanoic acid
OPENEYE Name: (2S)-2-[[(2S)-2-[[(2S)-2-[[2-[[(2R)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]propanoyl]amino]acetyl]amino]-3-phenyl-propanoyl]amino]-4-methyl-pentanoyl]amino]-3-hydroxy-propanoic acid
IUPAC Name: (2S)-2-[[(2S)-2-[[(2S)-2-[[2-[[(2R)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]propanoyl]amino]acetyl]amino]-3-phenylpropanoyl]amino]-4-methylpentanoyl]amino]-3-hydroxypropanoic acid
SYSTEMATIC NAME: (2S)-2-[[(2S)-2-[[(2S)-2-[2-[[(2R)-2-[[(2S)-2-azanyl-3-(4-hydroxyphenyl)propanoyl]amino]propanoyl]amino]ethanoylamino]-3-phenyl-propanoyl]amino]-4-methyl-pentanoyl]amino]-3-oxidanyl-propanoic acid
MOLECULAR FORMULA: C32H44N6O9
MOLECULAR WEIGHT: 656.72656
SMILES: C[C@H](C(=O)NCC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)O)NC(=O)[C@H](CC2=CC=C(C=C2)O)N
Structure:
CAS RN: 78886-46-1
CAS Name: N'-[(E)-[5-(hydroxymethyl)-2-methyl-3-oxo-4-pyridinylidene]methyl]-4-pyridinecarbohydrazide hydrochloride
OPENEYE Name: N'-[(E)-[5-(hydroxymethyl)-2-methyl-3-oxo-4-pyridylidene]methyl]pyridine-4-carbohydrazide hydrochloride
IUPAC Name: N'-[(E)-[5-(hydroxymethyl)-2-methyl-3-oxopyridin-4-ylidene]methyl]pyridine-4-carbohydrazide hydrochloride
SYSTEMATIC NAME: N'-[(E)-[5-(hydroxymethyl)-2-methyl-3-oxidanylidene-pyridin-4-ylidene]methyl]pyridine-4-carbohydrazide hydrochloride
MOLECULAR FORMULA: C14H15ClN4O3
MOLECULAR WEIGHT: 322.7469
SMILES: CC1=NC=C(/C(=C\NNC(=O)C2=CC=NC=C2)/C1=O)CO.Cl
Structure:
CAS RN: 78886-40-5
CAS Name: (4E)-5-(hydroxymethyl)-2-methyl-4-[[(4-phenyl-2-thiazolyl)hydrazo]methylidene]-3-pyridinone hydrochloride
OPENEYE Name: (4E)-5-(hydroxymethyl)-2-methyl-4-[[2-(4-phenylthiazol-2-yl)hydrazino]methylene]pyridin-3-one hydrochloride
IUPAC Name: (4E)-5-(hydroxymethyl)-2-methyl-4-[[2-(4-phenyl-1,3-thiazol-2-yl)hydrazinyl]methylidene]pyridin-3-one hydrochloride
SYSTEMATIC NAME: (4E)-5-(hydroxymethyl)-2-methyl-4-[[2-(4-phenyl-1,3-thiazol-2-yl)hydrazinyl]methylidene]pyridin-3-one hydrochloride
MOLECULAR FORMULA: C17H17ClN4O2S
MOLECULAR WEIGHT: 376.86048
SMILES: CC1=NC=C(/C(=C\NNC2=NC(=CS2)C3=CC=CC=C3)/C1=O)CO.Cl
Structure:
CAS RN: 78886-43-8
CAS Name: (4E)-5-(hydroxymethyl)-2-methyl-4-[[(4-methyl-2-thiazolyl)hydrazo]methylidene]-3-pyridinone
OPENEYE Name: (4E)-5-(hydroxymethyl)-2-methyl-4-[[2-(4-methylthiazol-2-yl)hydrazino]methylene]pyridin-3-one
IUPAC Name: (4E)-5-(hydroxymethyl)-2-methyl-4-[[2-(4-methyl-1,3-thiazol-2-yl)hydrazinyl]methylidene]pyridin-3-one
SYSTEMATIC NAME: (4E)-5-(hydroxymethyl)-2-methyl-4-[[2-(4-methyl-1,3-thiazol-2-yl)hydrazinyl]methylidene]pyridin-3-one
MOLECULAR FORMULA: C12H14N4O2S
MOLECULAR WEIGHT: 278.33016
SMILES: CC1=CSC(=N1)NN/C=C/2\C(=CN=C(C2=O)C)CO
Structure:
CAS RN: 78886-39-2
CAS Name: (4E)-5-(hydroxymethyl)-2-methyl-4-[[(4-methyl-2-thiazolyl)hydrazo]methylidene]-3-pyridinone hydrochloride
OPENEYE Name: (4E)-5-(hydroxymethyl)-2-methyl-4-[[2-(4-methylthiazol-2-yl)hydrazino]methylene]pyridin-3-one hydrochloride
IUPAC Name: (4E)-5-(hydroxymethyl)-2-methyl-4-[[2-(4-methyl-1,3-thiazol-2-yl)hydrazinyl]methylidene]pyridin-3-one hydrochloride
SYSTEMATIC NAME: (4E)-5-(hydroxymethyl)-2-methyl-4-[[2-(4-methyl-1,3-thiazol-2-yl)hydrazinyl]methylidene]pyridin-3-one hydrochloride
MOLECULAR FORMULA: C12H15ClN4O2S
MOLECULAR WEIGHT: 314.7911
SMILES: CC1=CSC(=N1)NN/C=C/2\C(=CN=C(C2=O)C)CO.Cl
Structure:
CAS RN: 139292-26-5
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C19H22N2O4S
MOLECULAR WEIGHT: 374.45398
SMILES: CN1CCC23[C@@H]4C(=O)CC[C@]2([C@H]1CC5=C3C(=C(C=C5)O)O4)NC(=O)CS
Structure:
CAS RN: 115053-54-8
CAS Name: 3-amino-4-[6-(2-amino-2-carboxyethyl)-2-(2-amino-3-hydroxy-1-oxobutyl)-3-hydroxyphenyl]-4-oxobutanoic acid
OPENEYE Name: 3-amino-4-[6-(2-amino-2-carboxy-ethyl)-2-(2-amino-3-hydroxy-butanoyl)-3-hydroxy-phenyl]-4-oxo-butanoic acid
IUPAC Name: 3-amino-4-[6-(2-amino-2-carboxyethyl)-2-(2-amino-3-hydroxybutanoyl)-3-hydroxyphenyl]-4-oxobutanoic acid
SYSTEMATIC NAME: 3-azanyl-4-[2-(2-azanyl-3-oxidanyl-butanoyl)-6-(2-azanyl-3-oxidanyl-3-oxidanylidene-propyl)-3-oxidanyl-phenyl]-4-oxidanylidene-butanoic acid
MOLECULAR FORMULA: C17H23N3O8
MOLECULAR WEIGHT: 397.37982
SMILES: CC(C(C(=O)C1=C(C=CC(=C1C(=O)C(CC(=O)O)N)CC(C(=O)O)N)O)N)O
Structure:
CAS RN: 79971-07-6
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C23H17N5O8
MOLECULAR WEIGHT: 491.40978
SMILES: COC1=C2C(=C3C4C(C(OC4OC3=C1)N5C=NC6=C5NC(=NC6=O)N)O)OC7=C(C2=O)C(=CC=C7)O
Structure:
CAS RN: 79953-10-9
CAS Name: 4-[(2E)-2-[[9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)-2-oxolanyl]-6-oxo-3H-purin-2-yl]imino]hydrazinyl]benzenesulfonic acid
OPENEYE Name: 4-[(2E)-2-[[9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-6-oxo-3H-purin-2-yl]imino]hydrazino]benzenesulfonic acid
IUPAC Name: 4-[(2E)-2-[[9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-6-oxo-3H-purin-2-yl]imino]hydrazinyl]benzenesulfonic acid
SYSTEMATIC NAME: 4-[(2E)-2-[[9-[(2R,3R,4S,5R)-5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]-6-oxidanylidene-3H-purin-2-yl]imino]hydrazinyl]benzenesulfonic acid
MOLECULAR FORMULA: C16H17N7O8S
MOLECULAR WEIGHT: 467.41328
SMILES: C1=CC(=CC=C1N/N=N/C2=NC(=O)C3=C(N2)N(C=N3)[C@H]4[C@@H]([C@@H]([C@H](O4)CO)O)O)S(=O)(=O)O
Structure:
CAS RN: 78886-47-2
CAS Name: N-[[(E)-[5-(hydroxymethyl)-2-methyl-3-oxo-4-pyridinylidene]methyl]amino]carbamic acid ethyl ester hydrochloride
OPENEYE Name: ethyl N-[[(E)-[5-(hydroxymethyl)-2-methyl-3-oxo-4-pyridylidene]methyl]amino]carbamate hydrochloride
IUPAC Name: ethyl N-[[(E)-[5-(hydroxymethyl)-2-methyl-3-oxopyridin-4-ylidene]methyl]amino]carbamate hydrochloride
SYSTEMATIC NAME: ethyl N-[[(E)-[5-(hydroxymethyl)-2-methyl-3-oxidanylidene-pyridin-4-ylidene]methyl]amino]carbamate hydrochloride
MOLECULAR FORMULA: C11H16ClN3O4
MOLECULAR WEIGHT: 289.71544
SMILES: CCOC(=O)NN/C=C/1\C(=CN=C(C1=O)C)CO.Cl
Structure:
CAS RN: 78886-44-9
CAS Name: (4E)-5-(hydroxymethyl)-2-methyl-4-[[(4-phenyl-2-thiazolyl)hydrazo]methylidene]-3-pyridinone
OPENEYE Name: (4E)-5-(hydroxymethyl)-2-methyl-4-[[2-(4-phenylthiazol-2-yl)hydrazino]methylene]pyridin-3-one
IUPAC Name: (4E)-5-(hydroxymethyl)-2-methyl-4-[[2-(4-phenyl-1,3-thiazol-2-yl)hydrazinyl]methylidene]pyridin-3-one
SYSTEMATIC NAME: (4E)-5-(hydroxymethyl)-2-methyl-4-[[2-(4-phenyl-1,3-thiazol-2-yl)hydrazinyl]methylidene]pyridin-3-one
MOLECULAR FORMULA: C17H16N4O2S
MOLECULAR WEIGHT: 340.39954
SMILES: CC1=NC=C(/C(=C\NNC2=NC(=CS2)C3=CC=CC=C3)/C1=O)CO
Structure:
CAS RN: 78886-41-6
CAS Name: N-[[(E)-[5-(hydroxymethyl)-2-methyl-3-oxo-4-pyridinylidene]methyl]amino]carbamic acid ethyl ester
OPENEYE Name: ethyl N-[[(E)-[5-(hydroxymethyl)-2-methyl-3-oxo-4-pyridylidene]methyl]amino]carbamate
IUPAC Name: ethyl N-[[(E)-[5-(hydroxymethyl)-2-methyl-3-oxopyridin-4-ylidene]methyl]amino]carbamate
SYSTEMATIC NAME: ethyl N-[[(E)-[5-(hydroxymethyl)-2-methyl-3-oxidanylidene-pyridin-4-ylidene]methyl]amino]carbamate
MOLECULAR FORMULA: C11H15N3O4
MOLECULAR WEIGHT: 253.2545
SMILES: CCOC(=O)NN/C=C/1\C(=CN=C(C1=O)C)CO
Structure:
CAS RN: 78886-42-7
CAS Name: N-[[(E)-[5-(hydroxymethyl)-2-methyl-3-oxo-4-pyridinylidene]methyl]amino]carbamic acid tert-butyl ester
OPENEYE Name: tert-butyl N-[[(E)-[5-(hydroxymethyl)-2-methyl-3-oxo-4-pyridylidene]methyl]amino]carbamate
IUPAC Name: tert-butyl N-[[(E)-[5-(hydroxymethyl)-2-methyl-3-oxopyridin-4-ylidene]methyl]amino]carbamate
SYSTEMATIC NAME: tert-butyl N-[[(E)-[5-(hydroxymethyl)-2-methyl-3-oxidanylidene-pyridin-4-ylidene]methyl]amino]carbamate
MOLECULAR FORMULA: C13H19N3O4
MOLECULAR WEIGHT: 281.30766
SMILES: CC1=NC=C(/C(=C\NNC(=O)OC(C)(C)C)/C1=O)CO
Structure:
CAS RN: 78886-38-1
CAS Name: N-[[(E)-[5-(hydroxymethyl)-2-methyl-3-oxo-4-pyridinylidene]methyl]amino]carbamic acid tert-butyl ester hydrochloride
OPENEYE Name: tert-butyl N-[[(E)-[5-(hydroxymethyl)-2-methyl-3-oxo-4-pyridylidene]methyl]amino]carbamate hydrochloride
IUPAC Name: tert-butyl N-[[(E)-[5-(hydroxymethyl)-2-methyl-3-oxopyridin-4-ylidene]methyl]amino]carbamate hydrochloride
SYSTEMATIC NAME: tert-butyl N-[[(E)-[5-(hydroxymethyl)-2-methyl-3-oxidanylidene-pyridin-4-ylidene]methyl]amino]carbamate hydrochloride
MOLECULAR FORMULA: C13H20ClN3O4
MOLECULAR WEIGHT: 317.7686
SMILES: CC1=NC=C(/C(=C\NNC(=O)OC(C)(C)C)/C1=O)CO.Cl
Structure:
CAS RN: 71407-32-4
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C39H42O10
MOLECULAR WEIGHT: 670.74478
SMILES: C[C@@H]1C[C@]2([C@H]3[C@H]4C1([C@@H]5C=C(C(=O)[C@]5(CC(=C4)COC(=O)CC6=CC(=C(C=C6)OC(=O)C)OC)O)C)O[C@@](O3)(O2)CC7=CC=CC=C7)C(=C)C
Structure:
CAS RN: 69133-14-8
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C19H22ClNO4
MOLECULAR WEIGHT: 363.83528
SMILES: C=CCN1CC[C@@]23[C@H]4C(=O)CC[C@@]2([C@@H]1CC5=C3C(=C(C=C5)O)O4)O.Cl
Structure:
CAS RN: 34114-04-0
CAS Name: (6Z)-3-(5-tert-butyl-1,3-benzoxazol-2-yl)-6-(5-tert-butyl-3H-1,3-benzoxazol-2-ylidene)-1-cyclohexa-2,4-dienethione
OPENEYE Name: (6Z)-3-(5-tert-butyl-1,3-benzoxazol-2-yl)-6-(5-tert-butyl-3H-1,3-benzoxazol-2-ylidene)cyclohexa-2,4-diene-1-thione
IUPAC Name: (6Z)-3-(5-tert-butyl-1,3-benzoxazol-2-yl)-6-(5-tert-butyl-3H-1,3-benzoxazol-2-ylidene)cyclohexa-2,4-diene-1-thione
SYSTEMATIC NAME: (6Z)-3-(5-tert-butyl-1,3-benzoxazol-2-yl)-6-(5-tert-butyl-3H-1,3-benzoxazol-2-ylidene)cyclohexa-2,4-diene-1-thione
MOLECULAR FORMULA: C28H28N2O2S
MOLECULAR WEIGHT: 456.59912
SMILES: CC(C)(C)C1=CC2=C(C=C1)O/C(=C\3/C=CC(=CC3=S)C4=NC5=C(O4)C=CC(=C5)C(C)(C)C)/N2
Structure:
CAS RN: 89999-09-7
CAS Name: (3Z)-6-chloro-3-[mercapto-(4-methylanilino)methylidene]-3,4-dihydro-2H-1-benzopyran-2,4-dione
OPENEYE Name: (3Z)-6-chloro-3-[(4-methylanilino)-sulfanyl-methylene]chromane-2,4-dione
IUPAC Name: (3Z)-6-chloro-3-[(4-methylanilino)-sulfanylmethylidene]chromene-2,4-dione
SYSTEMATIC NAME: (3Z)-6-chloranyl-3-[[(4-methylphenyl)amino]-sulfanyl-methylidene]chromene-2,4-dione
MOLECULAR FORMULA: C17H12ClNO3S
MOLECULAR WEIGHT: 345.80008
SMILES: CC1=CC=C(C=C1)N/C(=C/2\C(=O)C3=C(C=CC(=C3)Cl)OC2=O)/S
Structure:
CAS RN: 89999-06-4
CAS Name: (3Z)-3-[mercapto-(4-methoxyanilino)methylidene]-3,4-dihydro-2H-1-benzopyran-2,4-dione
OPENEYE Name: (3Z)-3-[(4-methoxyanilino)-sulfanyl-methylene]chromane-2,4-dione
IUPAC Name: (3Z)-3-[(4-methoxyanilino)-sulfanylmethylidene]chromene-2,4-dione
SYSTEMATIC NAME: (3Z)-3-[[(4-methoxyphenyl)amino]-sulfanyl-methylidene]chromene-2,4-dione
MOLECULAR FORMULA: C17H13NO4S
MOLECULAR WEIGHT: 327.35442
SMILES: COC1=CC=C(C=C1)N/C(=C/2\C(=O)C3=CC=CC=C3OC2=O)/S
Structure:
No comments:
Post a Comment