CAS RN: 121864-87-7
CAS Name: 2-[(2Z)-2-[4-formyl-6-methyl-5-oxo-3-(phosphonooxymethyl)-2-pyridinylidene]hydrazinyl]benzenesulfonic acid
OPENEYE Name: 2-[(2Z)-2-[4-formyl-6-methyl-5-oxo-3-(phosphonooxymethyl)-2-pyridylidene]hydrazino]benzenesulfonic acid
IUPAC Name: 2-[(2Z)-2-[4-formyl-6-methyl-5-oxo-3-(phosphonooxymethyl)pyridin-2-ylidene]hydrazinyl]benzenesulfonic acid
SYSTEMATIC NAME: 2-[(2Z)-2-[4-methanoyl-6-methyl-5-oxidanylidene-3-(phosphonooxymethyl)pyridin-2-ylidene]hydrazinyl]benzenesulfonic acid
MOLECULAR FORMULA: C14H14N3O9PS
MOLECULAR WEIGHT: 431.314421
SMILES: CC1=N/C(=N\NC2=CC=CC=C2S(=O)(=O)O)/C(=C(C1=O)C=O)COP(=O)(O)O
Structure:
CAS RN: 121520-98-7
CAS Name: (6E)-6-(1H-benzimidazol-2-ylhydrazinylidene)-2-(dihydroxymethylidene)cyclohex-4-ene-1,3-dione
OPENEYE Name: (6E)-6-(1H-benzimidazol-2-ylhydrazono)-2-(dihydroxymethylene)cyclohex-4-ene-1,3-dione
IUPAC Name: (6E)-6-(1H-benzimidazol-2-ylhydrazinylidene)-2-(dihydroxymethylidene)cyclohex-4-ene-1,3-dione
SYSTEMATIC NAME: (6E)-6-(1H-benzimidazol-2-ylhydrazinylidene)-2-[bis(oxidanyl)methylidene]cyclohex-4-ene-1,3-dione
MOLECULAR FORMULA: C14H10N4O4
MOLECULAR WEIGHT: 298.2536
SMILES: C1=CC=C2C(=C1)NC(=N2)N/N=C/3\C=CC(=O)C(=C(O)O)C3=O
Structure:
CAS RN: 121496-63-7
CAS Name: 1-[(E)-[(2E)-2-[[amino(3-aminopropylimino)methyl]hydrazinylidene]ethylidene]amino]-2-(3-aminopropyl)guanidine
OPENEYE Name: 2-(3-aminopropyl)-1-[(E)-[(2E)-2-[[N'-(3-aminopropyl)carbamimidoyl]hydrazono]ethylidene]amino]guanidine
IUPAC Name: 2-(3-aminopropyl)-1-[(E)-[(2E)-2-[[N'-(3-aminopropyl)carbamimidoyl]hydrazinylidene]ethylidene]amino]guanidine
SYSTEMATIC NAME: 2-(3-azanylpropyl)-1-[(E)-[(2E)-2-[[N'-(3-azanylpropyl)carbamimidoyl]hydrazinylidene]ethylidene]amino]guanidine
MOLECULAR FORMULA: C10H24N10
MOLECULAR WEIGHT: 284.36456
SMILES: C(CN=C(N/N=C/C=N/NC(=NCCCN)N)N)CN
Structure:
CAS RN: 120882-22-6
CAS Name: (6R,7R)-7-[[(2E)-2-(2-amino-4-thiazolyl)-2-methoxyimino-1-oxoethyl]amino]-3-(mercaptomethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
OPENEYE Name: (6R,7R)-7-[[(2E)-2-(2-aminothiazol-4-yl)-2-methoxyimino-acetyl]amino]-8-oxo-3-(sulfanylmethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
IUPAC Name: (6R,7R)-7-[[(2E)-2-(2-amino-1,3-thiazol-4-yl)-2-methoxyiminoacetyl]amino]-8-oxo-3-(sulfanylmethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
SYSTEMATIC NAME: (6R,7R)-7-[[(2E)-2-(2-azanyl-1,3-thiazol-4-yl)-2-methoxyimino-ethanoyl]amino]-8-oxidanylidene-3-(sulfanylmethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
MOLECULAR FORMULA: C14H15N5O5S3
MOLECULAR WEIGHT: 429.4944
SMILES: CO/N=C(\C1=CSC(=N1)N)/C(=O)N[C@H]2[C@@H]3N(C2=O)C(=C(CS3)CS)C(=O)O
Structure:
CAS RN: 120592-98-5
CAS Name: [(E)-4-(4-methyl-1,3-dioxo-2-isoindolyl)butan-2-ylideneamino]urea
OPENEYE Name: [(E)-[1-methyl-3-(4-methyl-1,3-dioxo-isoindolin-2-yl)propylidene]amino]urea
IUPAC Name: [(E)-4-(4-methyl-1,3-dioxoisoindol-2-yl)butan-2-ylideneamino]urea
SYSTEMATIC NAME: 1-[(E)-4-[4-methyl-1,3-bis(oxidanylidene)isoindol-2-yl]butan-2-ylideneamino]urea
MOLECULAR FORMULA: C14H16N4O3
MOLECULAR WEIGHT: 288.30184
SMILES: CC1=CC=CC2=C1C(=O)N(C2=O)CC/C(=N/NC(=O)N)/C
Structure:
CAS RN: 106061-25-0
CAS Name: 2-[4-[[(6S,7S)-7-[[(2E)-2-(2-amino-4-thiazolyl)-2-ethoxyimino-1-oxoethyl]amino]-2-carboxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl]methylthio]-1-pyridin-1-iumyl]acetate
OPENEYE Name: 2-[4-[[(6S,7S)-7-[[(2E)-2-(2-aminothiazol-4-yl)-2-ethoxyimino-acetyl]amino]-2-carboxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl]methylsulfanyl]pyridin-1-ium-1-yl]acetate
IUPAC Name: 2-[4-[[(6S,7S)-7-[[(2E)-2-(2-amino-1,3-thiazol-4-yl)-2-ethoxyiminoacetyl]amino]-2-carboxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl]methylsulfanyl]pyridin-1-ium-1-yl]acetate
SYSTEMATIC NAME: 2-[4-[[(6S,7S)-7-[[(2E)-2-(2-azanyl-1,3-thiazol-4-yl)-2-ethoxyimino-ethanoyl]amino]-2-carboxy-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl]methylsulfanyl]pyridin-1-ium-1-yl]ethanoate
MOLECULAR FORMULA: C22H22N6O7S3
MOLECULAR WEIGHT: 578.64108
SMILES: CCO/N=C(\C1=CSC(=N1)N)/C(=O)N[C@@H]2[C@H]3N(C2=O)C(=C(CS3)CSC4=CC=[N+](C=C4)CC(=O)[O-])C(=O)O
Structure:
CAS RN: 106036-65-1
CAS Name: (4S,6R,7S)-7-[[(2E)-2-(2-amino-4-thiazolyl)-2-(2-carboxypropan-2-yloxyimino)-1-oxoethyl]amino]-4-methyl-3-[[(1-methyl-4-pyridin-1-iumyl)thio]methyl]-8-oxo-5-oxa-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
OPENEYE Name: (4S,6R,7S)-7-[[(2E)-2-(2-aminothiazol-4-yl)-2-(1-carboxy-1-methyl-ethoxy)imino-acetyl]amino]-4-methyl-3-[(1-methylpyridin-1-ium-4-yl)sulfanylmethyl]-8-oxo-5-oxa-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
IUPAC Name: (4S,6R,7S)-7-[[(2E)-2-(2-amino-1,3-thiazol-4-yl)-2-(2-carboxypropan-2-yloxyimino)acetyl]amino]-4-methyl-3-[(1-methylpyridin-1-ium-4-yl)sulfanylmethyl]-8-oxo-5-oxa-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
SYSTEMATIC NAME: (4S,6R,7S)-7-[[(2E)-2-(2-azanyl-1,3-thiazol-4-yl)-2-(2-methyl-1-oxidanyl-1-oxidanylidene-propan-2-yl)oxyimino-ethanoyl]amino]-4-methyl-3-[(1-methylpyridin-1-ium-4-yl)sulfanylmethyl]-8-oxidanylidene-5-oxa-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
MOLECULAR FORMULA: C24H26N6O8S2
MOLECULAR WEIGHT: 590.62864
SMILES: C[C@H]1C(=C(N2[C@H](O1)[C@@H](C2=O)NC(=O)/C(=N/OC(C)(C)C(=O)O)/C3=CSC(=N3)N)C(=O)[O-])CSC4=CC=[N+](C=C4)C
Structure:
CAS RN: 105980-35-6
CAS Name: (6R,7R)-7-[[(2E)-2-(2-amino-4-thiazolyl)-2-methoxyimino-1-oxoethyl]amino]-3-(1,3-dithiolan-2-yl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
OPENEYE Name: (6R,7R)-7-[[(2E)-2-(2-aminothiazol-4-yl)-2-methoxyimino-acetyl]amino]-3-(1,3-dithiolan-2-yl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
IUPAC Name: (6R,7R)-7-[[(2E)-2-(2-amino-1,3-thiazol-4-yl)-2-methoxyiminoacetyl]amino]-3-(1,3-dithiolan-2-yl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
SYSTEMATIC NAME: (6R,7R)-7-[[(2E)-2-(2-azanyl-1,3-thiazol-4-yl)-2-methoxyimino-ethanoyl]amino]-3-(1,3-dithiolan-2-yl)-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
MOLECULAR FORMULA: C16H17N5O5S4
MOLECULAR WEIGHT: 487.59668
SMILES: CO/N=C(\C1=CSC(=N1)N)/C(=O)N[C@H]2[C@@H]3N(C2=O)C(=C(CS3)C4SCCS4)C(=O)O
Structure:
CAS RN: 120411-99-6
CAS Name: N-[(2E)-2-[[(2S)-2-acetamido-1-oxopropyl]hydrazinylidene]-3-phenylpropyl]benzamide
OPENEYE Name: N-[(2E)-2-[[(2S)-2-acetamidopropanoyl]hydrazono]-3-phenyl-propyl]benzamide
IUPAC Name: N-[(2E)-2-[[(2S)-2-acetamidopropanoyl]hydrazinylidene]-3-phenylpropyl]benzamide
SYSTEMATIC NAME: N-[(2E)-2-[[(2S)-2-acetamidopropanoyl]hydrazinylidene]-3-phenyl-propyl]benzamide
MOLECULAR FORMULA: C21H24N4O3
MOLECULAR WEIGHT: 380.44026
SMILES: C[C@@H](C(=O)N/N=C(\CC1=CC=CC=C1)/CNC(=O)C2=CC=CC=C2)NC(=O)C
Structure:
CAS RN: 105802-70-8
CAS Name: (Z)-3-[(S)-2-pyridinylsulfinyl]-2-propenoic acid [(1R,2R,5S)-5-methyl-2-propan-2-ylcyclohexyl] ester
OPENEYE Name: [(1R,2R,5S)-2-isopropyl-5-methyl-cyclohexyl] (Z)-3-[(S)-2-pyridylsulfinyl]prop-2-enoate
IUPAC Name: [(1R,2R,5S)-5-methyl-2-propan-2-ylcyclohexyl] (Z)-3-[(S)-pyridin-2-ylsulfinyl]prop-2-enoate
SYSTEMATIC NAME: [(1R,2R,5S)-5-methyl-2-propan-2-yl-cyclohexyl] (Z)-3-[(S)-pyridin-2-ylsulfinyl]prop-2-enoate
MOLECULAR FORMULA: C18H25NO3S
MOLECULAR WEIGHT: 335.461
SMILES: C[C@H]1CC[C@@H]([C@@H](C1)OC(=O)/C=C\[S@](=O)C2=CC=CC=N2)C(C)C
Structure:
CAS RN: 105632-75-5
CAS Name: (2E)-2-cyano-N-[[ethyl(nitroso)amino]-oxomethyl]-2-methoxyiminoacetamide
OPENEYE Name: (1E)-2-[[ethyl(nitroso)carbamoyl]amino]-N-methoxy-2-oxo-acetimidoyl cyanide
IUPAC Name: (1E)-2-[[ethyl(nitroso)carbamoyl]amino]-N-methoxy-2-oxoethanimidoyl cyanide
SYSTEMATIC NAME: (2E)-2-cyano-N-[ethyl(nitroso)carbamoyl]-2-methoxyimino-ethanamide
MOLECULAR FORMULA: C7H9N5O4
MOLECULAR WEIGHT: 227.17746
SMILES: CCN(C(=O)NC(=O)/C(=N/OC)/C#N)N=O
Structure:
CAS RN: 89408-03-7
CAS Name: N-[(Z)-1-thiophen-2-ylethylideneamino]-2-thiazolamine
OPENEYE Name: N-[(Z)-1-(2-thienyl)ethylideneamino]thiazol-2-amine
IUPAC Name: N-[(Z)-1-thiophen-2-ylethylideneamino]-1,3-thiazol-2-amine
SYSTEMATIC NAME: N-[(Z)-1-thiophen-2-ylethylideneamino]-1,3-thiazol-2-amine
MOLECULAR FORMULA: C9H9N3S2
MOLECULAR WEIGHT: 223.31786
SMILES: C/C(=N/NC1=NC=CS1)/C2=CC=CS2
Structure:
CAS RN: 104013-53-8
CAS Name: (3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanone oxime
OPENEYE Name: (3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-one oxime
IUPAC Name: (2Z,3R,4S,5S,6R)-2-hydroxyimino-6-(hydroxymethyl)oxane-3,4,5-triol
SYSTEMATIC NAME: (2Z,3R,4S,5S,6R)-2-hydroxyimino-6-(hydroxymethyl)oxane-3,4,5-triol
MOLECULAR FORMULA: C6H11NO6
MOLECULAR WEIGHT: 193.15464
SMILES: C([C@@H]1[C@H]([C@@H]([C@H](/C(=N/O)/O1)O)O)O)O
Structure:
CAS RN: 81948-65-4
CAS Name: 9-[(6-aminopurin-9-yl)-diphenylstannyl]-6-purinamine
OPENEYE Name: 9-[(6-aminopurin-9-yl)-diphenyl-stannyl]purin-6-amine
IUPAC Name: 9-[(6-aminopurin-9-yl)-diphenylstannyl]purin-6-amine
SYSTEMATIC NAME: 9-[(6-aminopurin-9-yl)-diphenyl-stannyl]purin-6-amine
MOLECULAR FORMULA: C22H18N10Sn
MOLECULAR WEIGHT: 541.15532
SMILES: C1=CC=C(C=C1)[Sn](C2=CC=CC=C2)(N3C=NC4=C3N=CN=C4N)N5C=NC6=C5N=CN=C6N
Structure:
CAS RN: 80214-88-6
CAS Name: (7S,9S)-7-[[(2R,4S,5S,6S)-4-amino-5-hydroxy-6-methyl-2-oxanyl]oxy]-6,9,11-trihydroxy-9-[(1E)-1-[(1-hydroxy-2,2,6,6-tetramethyl-4-piperidinylidene)hydrazinylidene]ethyl]-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione hydrochloride
OPENEYE Name: (7S,9S)-7-[(2R,4S,5S,6S)-4-amino-5-hydroxy-6-methyl-tetrahydropyran-2-yl]oxy-6,9,11-trihydroxy-9-[(E)-N-[(1-hydroxy-2,2,6,6-tetramethyl-4-piperidylidene)amino]-C-methyl-carbonimidoyl]-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione hydrochloride
IUPAC Name: (7S,9S)-7-[(2R,4S,5S,6S)-4-amino-5-hydroxy-6-methyloxan-2-yl]oxy-6,9,11-trihydroxy-9-[(E)-N-[(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-ylidene)amino]-C-methylcarbonimidoyl]-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione hydrochloride
SYSTEMATIC NAME: (7S,9S)-7-[(2R,4S,5S,6S)-4-azanyl-6-methyl-5-oxidanyl-oxan-2-yl]oxy-4-methoxy-9-[(E)-C-methyl-N-[(2,2,6,6-tetramethyl-1-oxidanyl-piperidin-4-ylidene)amino]carbonimidoyl]-6,9,11-tris(oxidanyl)-8,10-dihydro-7H-tetracene-5,12-dione hydrochloride
MOLECULAR FORMULA: C36H47ClN4O10
MOLECULAR WEIGHT: 731.23218
SMILES: C[C@H]1[C@H]([C@H](C[C@@H](O1)O[C@H]2C[C@@](CC3=C(C4=C(C(=C23)O)C(=O)C5=C(C4=O)C=CC=C5OC)O)(/C(=N/N=C6CC(N(C(C6)(C)C)O)(C)C)/C)O)N)O.Cl
Structure:
CAS RN: 83138-78-7
CAS Name: (7S,9S)-7-[[(2R,4S,5S,6S)-4-amino-5-hydroxy-6-methyl-2-oxanyl]oxy]-6,9,11-trihydroxy-9-[(1E)-1-[(1-hydroxy-2,2,6,6-tetramethyl-4-piperidinylidene)hydrazinylidene]ethyl]-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione hydrochloride
OPENEYE Name: (7S,9S)-7-[(2R,4S,5S,6S)-4-amino-5-hydroxy-6-methyl-tetrahydropyran-2-yl]oxy-6,9,11-trihydroxy-9-[(E)-N-[(1-hydroxy-2,2,6,6-tetramethyl-4-piperidylidene)amino]-C-methyl-carbonimidoyl]-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione hydrochloride
IUPAC Name: (7S,9S)-7-[(2R,4S,5S,6S)-4-amino-5-hydroxy-6-methyloxan-2-yl]oxy-6,9,11-trihydroxy-9-[(E)-N-[(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-ylidene)amino]-C-methylcarbonimidoyl]-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione hydrochloride
SYSTEMATIC NAME: (7S,9S)-7-[(2R,4S,5S,6S)-4-azanyl-6-methyl-5-oxidanyl-oxan-2-yl]oxy-4-methoxy-9-[(E)-C-methyl-N-[(2,2,6,6-tetramethyl-1-oxidanyl-piperidin-4-ylidene)amino]carbonimidoyl]-6,9,11-tris(oxidanyl)-8,10-dihydro-7H-tetracene-5,12-dione hydrochloride
MOLECULAR FORMULA: C36H47ClN4O10
MOLECULAR WEIGHT: 731.23218
SMILES: C[C@H]1[C@H]([C@H](C[C@@H](O1)O[C@H]2C[C@@](CC3=C(C4=C(C(=C23)O)C(=O)C5=C(C4=O)C=CC=C5OC)O)(/C(=N/N=C6CC(N(C(C6)(C)C)O)(C)C)/C)O)N)O.Cl
Structure:
CAS RN: 63332-84-3
CAS Name: N'-[(E)-1,3-benzoxazol-2-ylmethylideneamino]carbamimidothioic acid ethyl ester
OPENEYE Name: 3-[(E)-1,3-benzoxazol-2-ylmethyleneamino]-2-ethyl-isothiourea
IUPAC Name: ethyl N'-[(E)-1,3-benzoxazol-2-ylmethylideneamino]carbamimidothioate
SYSTEMATIC NAME: ethyl N'-[(E)-1,3-benzoxazol-2-ylmethylideneamino]carbamimidothioate
MOLECULAR FORMULA: C11H12N4OS
MOLECULAR WEIGHT: 248.30418
SMILES: CCS/C(=N/N=C/C1=NC2=CC=CC=C2O1)/N
Structure:
CAS RN: 103313-22-0
CAS Name: (6R,7R)-7-[[(2E)-2-(2-amino-4-thiazolyl)-2-methoxyimino-1-oxoethyl]amino]-3-(2-imidazo[1,5-a]pyridin-4-iumylmethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
OPENEYE Name: (6R,7R)-7-[[(2E)-2-(2-aminothiazol-4-yl)-2-methoxyimino-acetyl]amino]-3-(imidazo[1,5-a]pyridin-4-ium-2-ylmethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
IUPAC Name: (6R,7R)-7-[[(2E)-2-(2-amino-1,3-thiazol-4-yl)-2-methoxyiminoacetyl]amino]-3-(imidazo[1,5-a]pyridin-4-ium-2-ylmethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
SYSTEMATIC NAME: (6R,7R)-7-[[(2E)-2-(2-azanyl-1,3-thiazol-4-yl)-2-methoxyimino-ethanoyl]amino]-3-(imidazo[1,5-a]pyridin-4-ium-2-ylmethyl)-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
MOLECULAR FORMULA: C21H19N7O5S2
MOLECULAR WEIGHT: 513.54946
SMILES: CO/N=C(\C1=CSC(=N1)N)/C(=O)N[C@H]2[C@@H]3N(C2=O)C(=C(CS3)CN4C=C5C=CC=C[N+]5=C4)C(=O)[O-]
Structure:
CAS RN: 103188-42-7
CAS Name: N-[(E)-[10-[(E)-[(1,3-dimethyl-2-imidazolidinylidene)hydrazinylidene]methyl]-9,10-dihydroanthracen-9-yl]methylideneamino]-1,3-dimethyl-2-imidazolidinimine
OPENEYE Name: N-[(E)-[10-[(E)-[(1,3-dimethylimidazolidin-2-ylidene)hydrazono]methyl]-9,10-dihydroanthracen-9-yl]methyleneamino]-1,3-dimethyl-imidazolidin-2-imine
IUPAC Name: N-[(E)-[10-[(E)-[(1,3-dimethylimidazolidin-2-ylidene)hydrazinylidene]methyl]-9,10-dihydroanthracen-9-yl]methylideneamino]-1,3-dimethylimidazolidin-2-imine
SYSTEMATIC NAME: N-[(E)-[10-[(E)-[(1,3-dimethylimidazolidin-2-ylidene)hydrazinylidene]methyl]-9,10-dihydroanthracen-9-yl]methylideneamino]-1,3-dimethyl-imidazolidin-2-imine
MOLECULAR FORMULA: C26H32N8
MOLECULAR WEIGHT: 456.58588
SMILES: CN1C(=N/N=C/C2C3=CC=CC=C3C(C4=CC=CC=C24)/C=N/N=C5N(CCN5C)C)N(CC1)C
Structure:
CAS RN: 179528-40-6
CAS Name: (1E)-1-(diaminomethylidenehydrazinylidene)-2,3-dihydroindene-4-carboxamide
OPENEYE Name: (1E)-1-(diaminomethylenehydrazono)indane-4-carboxamide
IUPAC Name: (1E)-1-(diaminomethylidenehydrazinylidene)-2,3-dihydroindene-4-carboxamide
SYSTEMATIC NAME: (1E)-1-[bis(azanyl)methylidenehydrazinylidene]-2,3-dihydroindene-4-carboxamide
MOLECULAR FORMULA: C11H13N5O
MOLECULAR WEIGHT: 231.25382
SMILES: C1C/C(=N\N=C(N)N)/C2=C1C(=CC=C2)C(=O)N
Structure:
CAS RN: 176391-41-6
CAS Name: 2-[[6-methyl-5-[2-[(E)-[phenyl(3-pyridinyl)methylidene]amino]oxyethyl]-7,8-dihydronaphthalen-1-yl]oxy]acetic acid
OPENEYE Name: 2-[[6-methyl-5-[2-[(E)-[phenyl(3-pyridyl)methylene]amino]oxyethyl]-7,8-dihydronaphthalen-1-yl]oxy]acetic acid
IUPAC Name: 2-[[6-methyl-5-[2-[(E)-[phenyl(pyridin-3-yl)methylidene]amino]oxyethyl]-7,8-dihydronaphthalen-1-yl]oxy]acetic acid
SYSTEMATIC NAME: 2-[[6-methyl-5-[2-[(E)-[phenyl(pyridin-3-yl)methylidene]amino]oxyethyl]-7,8-dihydronaphthalen-1-yl]oxy]ethanoic acid
MOLECULAR FORMULA: C27H26N2O4
MOLECULAR WEIGHT: 442.50634
SMILES: CC1=C(C2=C(CC1)C(=CC=C2)OCC(=O)O)CCO/N=C(\C3=CC=CC=C3)/C4=CN=CC=C4
Structure:
CAS RN: 168423-06-1
CAS Name: [(Z)-(4-hydroxy-3-methyl-2-oxo-1-naphthalenylidene)amino]urea
OPENEYE Name: [(Z)-(4-hydroxy-3-methyl-2-oxo-1-naphthylidene)amino]urea
IUPAC Name: [(Z)-(4-hydroxy-3-methyl-2-oxonaphthalen-1-ylidene)amino]urea
SYSTEMATIC NAME: 1-[(Z)-(3-methyl-4-oxidanyl-2-oxidanylidene-naphthalen-1-ylidene)amino]urea
MOLECULAR FORMULA: C12H11N3O3
MOLECULAR WEIGHT: 245.23404
SMILES: CC1=C(C2=CC=CC=C2/C(=N/NC(=O)N)/C1=O)O
Structure:
CAS RN: 65440-68-8
CAS Name: (NZ)-4-methyl-N-(1-phenylethylidene)benzenesulfinamide
OPENEYE Name: (NZ)-4-methyl-N-(1-phenylethylidene)benzenesulfinamide
IUPAC Name: (NZ)-4-methyl-N-(1-phenylethylidene)benzenesulfinamide
SYSTEMATIC NAME: (NZ)-4-methyl-N-(1-phenylethylidene)benzenesulfinamide
MOLECULAR FORMULA: C15H15NOS
MOLECULAR WEIGHT: 257.3507
SMILES: CC1=CC=C(C=C1)[S@](=O)/N=C(/C)\C2=CC=CC=C2
Structure:
CAS RN: 64849-53-2
CAS Name: 1-[(E)-[(1E)-1-[[anilino(sulfanylidene)methyl]hydrazinylidene]propan-2-ylidene]amino]-3-phenylthiourea
OPENEYE Name: 1-[(E)-[(2E)-1-methyl-2-(phenylcarbamothioylhydrazono)ethylidene]amino]-3-phenyl-thiourea
IUPAC Name: 1-phenyl-3-[(E)-[(1E)-1-(phenylcarbamothioylhydrazinylidene)propan-2-ylidene]amino]thiourea
SYSTEMATIC NAME: 1-phenyl-3-[(E)-[(1E)-1-(phenylcarbamothioylhydrazinylidene)propan-2-ylidene]amino]thiourea
MOLECULAR FORMULA: C17H18N6S2
MOLECULAR WEIGHT: 370.49502
SMILES: C/C(=N\NC(=S)NC1=CC=CC=C1)/C=N/NC(=S)NC2=CC=CC=C2
Structure:
CAS RN: 101365-17-7
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C23H24N4O5
MOLECULAR WEIGHT: 436.46046
SMILES: CN1CC[C@]23[C@@H]4/C(=N\NC5=CC=C(C=C5)[N+](=O)[O-])/CC[C@]2([C@H]1CC6=C3C(=C(C=C6)O)O4)O
Structure:
CAS RN: 101365-15-5
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C23H25N3O3
MOLECULAR WEIGHT: 391.4629
SMILES: CN1CC[C@]23[C@@H]4/C(=N\NC5=CC=CC=C5)/CC[C@]2([C@H]1CC6=C3C(=C(C=C6)O)O4)O
Structure:
CAS RN: 101233-99-2
CAS Name: (6R,7R)-7-[[(2E)-2-(2-amino-4-thiazolyl)-2-(carboxymethoxyimino)-1-oxoethyl]amino]-3-[[(1-methyl-6,7-dihydro-5H-cyclopenta[b]pyridin-1-ium-4-yl)thio]methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
OPENEYE Name: (6R,7R)-7-[[(2E)-2-(2-aminothiazol-4-yl)-2-(carboxymethoxyimino)acetyl]amino]-3-[(1-methyl-6,7-dihydro-5H-cyclopenta[b]pyridin-1-ium-4-yl)sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
IUPAC Name: (6R,7R)-7-[[(2E)-2-(2-amino-1,3-thiazol-4-yl)-2-(carboxymethoxyimino)acetyl]amino]-3-[(1-methyl-6,7-dihydro-5H-cyclopenta[b]pyridin-1-ium-4-yl)sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
SYSTEMATIC NAME: (6R,7R)-7-[[(2E)-2-(2-azanyl-1,3-thiazol-4-yl)-2-(2-hydroxy-2-oxoethyloxyimino)ethanoyl]amino]-3-[(1-methyl-6,7-dihydro-5H-cyclopenta[b]pyridin-1-ium-4-yl)sulfanylmethyl]-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
MOLECULAR FORMULA: C24H24N6O7S3
MOLECULAR WEIGHT: 604.67836
SMILES: C[N+]1=C2CCCC2=C(C=C1)SCC3=C(N4[C@@H]([C@@H](C4=O)NC(=O)/C(=N/OCC(=O)O)/C5=CSC(=N5)N)SC3)C(=O)[O-]
Structure:
CAS RN: 101041-95-6
CAS Name: N'-hydroxy-5,6-dimethoxy-1-benzothiophene-2-carboximidamide hydrochloride
OPENEYE Name: N'-hydroxy-5,6-dimethoxy-benzothiophene-2-carboxamidine hydrochloride
IUPAC Name: N'-hydroxy-5,6-dimethoxy-1-benzothiophene-2-carboximidamide hydrochloride
SYSTEMATIC NAME: 5,6-dimethoxy-N'-oxidanyl-1-benzothiophene-2-carboximidamide hydrochloride
MOLECULAR FORMULA: C11H13ClN2O3S
MOLECULAR WEIGHT: 288.75052
SMILES: COC1=C(C=C2C(=C1)C=C(S2)/C(=N/O)/N)OC.Cl
Structure:
CAS RN: 76896-81-6
CAS Name: N-[(E)-[(2E,4E,6E)-undeca-2,4,6-trienylidene]amino]nitrous amide
OPENEYE Name: N-[(E)-[(2E,4E,6E)-undeca-2,4,6-trienylidene]amino]nitrous amide
IUPAC Name: N-[(E)-[(2E,4E,6E)-undeca-2,4,6-trienylidene]amino]nitrous amide
SYSTEMATIC NAME: N-[(E)-[(2E,4E,6E)-undeca-2,4,6-trienylidene]amino]nitrous amide
MOLECULAR FORMULA: C11H17N3O
MOLECULAR WEIGHT: 207.27218
SMILES: CCCC/C=C/C=C/C=C/C=N/NN=O
Structure:
CAS RN: 76841-57-1
CAS Name: 1-(3',6'-dihydroxy-3-oxo-5-spiro[isobenzofuran-1,9'-xanthene]yl)-3-[(E)-[(8R,9S,13S,14S)-3-hydroxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-ylidene]amino]thiourea
OPENEYE Name: 1-(3',6'-dihydroxy-3-oxo-spiro[isobenzofuran-1,9'-xanthene]-5-yl)-3-[(E)-[(8R,9S,13S,14S)-3-hydroxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-ylidene]amino]thiourea
IUPAC Name: 1-(3',6'-dihydroxy-3-oxospiro[2-benzofuran-1,9'-xanthene]-5-yl)-3-[(E)-[(8R,9S,13S,14S)-3-hydroxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-ylidene]amino]thiourea
SYSTEMATIC NAME: 1-[3',6'-bis(oxidanyl)-3-oxidanylidene-spiro[2-benzofuran-1,9'-xanthene]-5-yl]-3-[(E)-[(8R,9S,13S,14S)-13-methyl-3-oxidanyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-ylidene]amino]thiourea
MOLECULAR FORMULA: C39H35N3O6S
MOLECULAR WEIGHT: 673.7767
SMILES: C[C@]1\2CC[C@H]3[C@H]([C@@H]1CC/C2=N\NC(=S)NC4=CC5=C(C=C4)C6(C7=C(C=C(C=C7)O)OC8=C6C=CC(=C8)O)OC5=O)CCC9=C3C=CC(=C9)O
Structure:
CAS RN: 100101-28-8
CAS Name: (10S)-N-[3-[4-[(2Z)-3-[2-(2-amino-1H-imidazol-5-yl)ethylamino]-2-hydroxyimino-3-oxopropyl]-2,6-dibromophenoxy]propyl]-7,9-dibromo-10-hydroxy-8-methoxy-4-oxa-3-azaspiro[4.5]deca-2,6,8-triene-2-carboxamide
OPENEYE Name: (10S)-N-[3-[4-[(2Z)-3-[2-(2-amino-1H-imidazol-5-yl)ethylamino]-2-hydroxyimino-3-oxo-propyl]-2,6-dibromo-phenoxy]propyl]-7,9-dibromo-10-hydroxy-8-methoxy-4-oxa-3-azaspiro[4.5]deca-2,6,8-triene-2-carboxamide
IUPAC Name: (10S)-N-[3-[4-[(2Z)-3-[2-(2-amino-1H-imidazol-5-yl)ethylamino]-2-hydroxyimino-3-oxopropyl]-2,6-dibromophenoxy]propyl]-7,9-dibromo-10-hydroxy-8-methoxy-4-oxa-3-azaspiro[4.5]deca-2,6,8-triene-2-carboxamide
SYSTEMATIC NAME: (10S)-N-[3-[4-[(2Z)-3-[2-(2-azanyl-1H-imidazol-5-yl)ethylamino]-2-hydroxyimino-3-oxidanylidene-propyl]-2,6-bis(bromanyl)phenoxy]propyl]-7,9-bis(bromanyl)-8-methoxy-10-oxidanyl-4-oxa-3-azaspiro[4.5]deca-2,6,8-triene-2-carboxamide
MOLECULAR FORMULA: C27H29Br4N7O7
MOLECULAR WEIGHT: 883.17786
SMILES: COC1=C([C@H](C2(CC(=NO2)C(=O)NCCCOC3=C(C=C(C=C3Br)C/C(=N/O)/C(=O)NCCC4=CN=C(N4)N)Br)C=C1Br)O)Br
Structure:
CAS RN: 99794-88-4
CAS Name: (2E,4E,6E,8E)-N-ethoxy-3,7-dimethyl-9-(2,6,6-trimethyl-1-cyclohexenyl)-1-nona-2,4,6,8-tetraenimine
OPENEYE Name: (2E,4E,6E,8E)-N-ethoxy-3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2,4,6,8-tetraen-1-imine
IUPAC Name: (2E,4E,6E,8E)-N-ethoxy-3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2,4,6,8-tetraen-1-imine
SYSTEMATIC NAME: (2E,4E,6E,8E)-N-ethoxy-3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2,4,6,8-tetraen-1-imine
MOLECULAR FORMULA: C22H33NO
MOLECULAR WEIGHT: 327.50352
SMILES: CCO/N=C/C=C(\C)/C=C/C=C(\C)/C=C/C1=C(CCCC1(C)C)C
Structure:
CAS RN: 99684-91-0
CAS Name: 4-chloro-2-hydroxy-6-methoxy-1-nitroso-2H-indol-3-one oxime
OPENEYE Name: 4-chloro-2-hydroxy-6-methoxy-1-nitroso-indolin-3-one oxime
IUPAC Name: (3E)-4-chloro-3-hydroxyimino-6-methoxy-1-nitroso-2H-indol-2-ol
SYSTEMATIC NAME: (3E)-4-chloranyl-3-hydroxyimino-6-methoxy-1-nitroso-2H-indol-2-ol
MOLECULAR FORMULA: C9H8ClN3O4
MOLECULAR WEIGHT: 257.63052
SMILES: COC1=CC(=C\2C(=C1)N(C(/C2=N/O)O)N=O)Cl
Structure:
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