Product OPENEYE NAME: (2S)-5-amino-2-[cyclohexylmethyl-[2-(6-methoxy-1H-indol-3-yl)-2-oxo-acetyl]amino]pentanoic acid
CAS Name: (2S)-5-amino-2-[cyclohexylmethyl-[2-(6-methoxy-1H-indol-3-yl)-1,2-dioxoethyl]amino]pentanoic acid
IUPAC NAME: (2S)-5-amino-2-[cyclohexylmethyl-[2-(6-methoxy-1H-indol-3-yl)-2-oxoacetyl]amino]pentanoic acid
SYSTEMATIC NAME: (2S)-5-azanyl-2-[cyclohexylmethyl-[2-(6-methoxy-1H-indol-3-yl)-2-oxidanylidene-ethanoyl]amino]pentanoic acid
MOLECULAR FORMULA: C23H31N3O5
MOLECULAR WEIGHT: 429.50934
SMILES: COC1=CC2=C(C=C1)C(=CN2)C(=O)C(=O)N(CC3CCCCC3)[C@@H](CCCN)C(=O)O
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Product OPENEYE NAME: N-(cyclohexylmethyl)-N-[2-[2-methoxyethyl(methyl)amino]-2-oxo-ethyl]-2-(6-methoxy-1H-indol-3-yl)-2-oxo-acetamide
CAS Name: N-(cyclohexylmethyl)-N-[2-[2-methoxyethyl(methyl)amino]-2-oxoethyl]-2-(6-methoxy-1H-indol-3-yl)-2-oxoacetamide
IUPAC NAME: N-(cyclohexylmethyl)-N-[2-[2-methoxyethyl(methyl)amino]-2-oxoethyl]-2-(6-methoxy-1H-indol-3-yl)-2-oxoacetamide
SYSTEMATIC NAME: N-(cyclohexylmethyl)-N-[2-[2-methoxyethyl(methyl)amino]-2-oxidanylidene-ethyl]-2-(6-methoxy-1H-indol-3-yl)-2-oxidanylidene-ethanamide
MOLECULAR FORMULA: C24H33N3O5
MOLECULAR WEIGHT: 443.53592
SMILES: CN(CCOC)C(=O)CN(CC1CCCCC1)C(=O)C(=O)C2=CNC3=C2C=CC(=C3)OC
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Product OPENEYE NAME: (4S)-4-amino-5-[[(1R)-1-carboxy-2-methylsulfinyl-ethyl]amino]-5-oxo-pentanoic acid
CAS Name: (4S)-4-amino-5-[[(1R)-1-carboxy-2-methylsulfinylethyl]amino]-5-oxopentanoic acid
IUPAC NAME: (4S)-4-amino-5-[[(1R)-1-carboxy-2-methylsulfinylethyl]amino]-5-oxopentanoic acid
SYSTEMATIC NAME: (4S)-4-azanyl-5-[[(2R)-3-methylsulfinyl-1-oxidanyl-1-oxidanylidene-propan-2-yl]amino]-5-oxidanylidene-pentanoic acid
MOLECULAR FORMULA: C9H16N2O6S
MOLECULAR WEIGHT: 280.29814
SMILES: CS(=O)C[C@@H](C(=O)O)NC(=O)[C@H](CCC(=O)O)N
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Product OPENEYE NAME: (2Z,4S,4aS,5aR,12aS)-2-[amino(hydroxy)methylene]-4-(dimethylamino)-10,11,12a-trihydroxy-7-[5-(morpholinomethyl)-2-furyl]-4a,5,5a,6-tetrahydro-4H-tetracene-1,3,12-trione
CAS Name: (2Z,4S,4aS,5aR,12aS)-2-[amino(hydroxy)methylidene]-4-(dimethylamino)-10,11,12a-trihydroxy-7-[5-(4-morpholinylmethyl)-2-furanyl]-4a,5,5a,6-tetrahydro-4H-tetracene-1,3,12-trione
IUPAC NAME: (2Z,4S,4aS,5aR,12aS)-2-[amino(hydroxy)methylidene]-4-(dimethylamino)-10,11,12a-trihydroxy-7-[5-(morpholin-4-ylmethyl)furan-2-yl]-4a,5,5a,6-tetrahydro-4H-tetracene-1,3,12-trione
SYSTEMATIC NAME: (2Z,4S,4aS,5aR,12aS)-2-[azanyl(oxidanyl)methylidene]-4-(dimethylamino)-7-[5-(morpholin-4-ylmethyl)furan-2-yl]-10,11,12a-tris(oxidanyl)-4a,5,5a,6-tetrahydro-4H-tetracene-1,3,12-trione
MOLECULAR FORMULA: C30H33N3O9
MOLECULAR WEIGHT: 579.59772
SMILES: CN(C)[C@H]1[C@@H]2C[C@@H]3CC4=C(C=CC(=C4C(=C3C(=O)[C@@]2(C(=O)/C(=C(/N)\O)/C1=O)O)O)O)C5=CC=C(O5)CN6CCOCC6
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Product OPENEYE NAME: (2Z,4S,4aS,5aR,12aS)-2-[amino(hydroxy)methylene]-4-(dimethylamino)-10,11,12a-trihydroxy-7-[2-(2-methylimidazol-1-yl)acetyl]-4a,5,5a,6-tetrahydro-4H-tetracene-1,3,12-trione
CAS Name: (2Z,4S,4aS,5aR,12aS)-2-[amino(hydroxy)methylidene]-4-(dimethylamino)-10,11,12a-trihydroxy-7-[2-(2-methyl-1-imidazolyl)-1-oxoethyl]-4a,5,5a,6-tetrahydro-4H-tetracene-1,3,12-trione
IUPAC NAME: (2Z,4S,4aS,5aR,12aS)-2-[amino(hydroxy)methylidene]-4-(dimethylamino)-10,11,12a-trihydroxy-7-[2-(2-methylimidazol-1-yl)acetyl]-4a,5,5a,6-tetrahydro-4H-tetracene-1,3,12-trione
SYSTEMATIC NAME: (2Z,4S,4aS,5aR,12aS)-2-[azanyl(oxidanyl)methylidene]-4-(dimethylamino)-7-[2-(2-methylimidazol-1-yl)ethanoyl]-10,11,12a-tris(oxidanyl)-4a,5,5a,6-tetrahydro-4H-tetracene-1,3,12-trione
MOLECULAR FORMULA: C27H28N4O8
MOLECULAR WEIGHT: 536.53322
SMILES: CC1=NC=CN1CC(=O)C2=C3C[C@H]4C[C@H]5[C@@H](C(=O)/C(=C(\N)/O)/C(=O)[C@]5(C(=O)C4=C(C3=C(C=C2)O)O)O)N(C)C
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Product OPENEYE NAME: (2Z,4S,4aS,5aR,12aS)-2-[amino(hydroxy)methylene]-4-(dimethylamino)-10,11,12a-trihydroxy-7-[3-[(4-methylpiperazin-1-yl)methyl]phenyl]-4a,5,5a,6-tetrahydro-4H-tetracene-1,3,12-trione
CAS Name: (2Z,4S,4aS,5aR,12aS)-2-[amino(hydroxy)methylidene]-4-(dimethylamino)-10,11,12a-trihydroxy-7-[3-[(4-methyl-1-piperazinyl)methyl]phenyl]-4a,5,5a,6-tetrahydro-4H-tetracene-1,3,12-trione
IUPAC NAME: (2Z,4S,4aS,5aR,12aS)-2-[amino(hydroxy)methylidene]-4-(dimethylamino)-10,11,12a-trihydroxy-7-[3-[(4-methylpiperazin-1-yl)methyl]phenyl]-4a,5,5a,6-tetrahydro-4H-tetracene-1,3,12-trione
SYSTEMATIC NAME: (2Z,4S,4aS,5aR,12aS)-2-[azanyl(oxidanyl)methylidene]-4-(dimethylamino)-7-[3-[(4-methylpiperazin-1-yl)methyl]phenyl]-10,11,12a-tris(oxidanyl)-4a,5,5a,6-tetrahydro-4H-tetracene-1,3,12-trione
MOLECULAR FORMULA: C33H38N4O7
MOLECULAR WEIGHT: 602.67742
SMILES: CN1CCN(CC1)CC2=CC=CC(=C2)C3=C4C[C@H]5C[C@H]6[C@@H](C(=O)/C(=C(\N)/O)/C(=O)[C@]6(C(=O)C5=C(C4=C(C=C3)O)O)O)N(C)C
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Product OPENEYE NAME: (2Z,4S,4aS,5aR,12aS)-2-[amino(hydroxy)methylene]-4-(dimethylamino)-7-[5-[[2-(dimethylamino)ethylamino]methyl]-2-furyl]-10,11,12a-trihydroxy-4a,5,5a,6-tetrahydro-4H-tetracene-1,3,12-trione
CAS Name: (2Z,4S,4aS,5aR,12aS)-2-[amino(hydroxy)methylidene]-4-(dimethylamino)-7-[5-[[2-(dimethylamino)ethylamino]methyl]-2-furanyl]-10,11,12a-trihydroxy-4a,5,5a,6-tetrahydro-4H-tetracene-1,3,12-trione
IUPAC NAME: (2Z,4S,4aS,5aR,12aS)-2-[amino(hydroxy)methylidene]-4-(dimethylamino)-7-[5-[[2-(dimethylamino)ethylamino]methyl]furan-2-yl]-10,11,12a-trihydroxy-4a,5,5a,6-tetrahydro-4H-tetracene-1,3,12-trione
SYSTEMATIC NAME: (2Z,4S,4aS,5aR,12aS)-2-[azanyl(oxidanyl)methylidene]-4-(dimethylamino)-7-[5-[[2-(dimethylamino)ethylamino]methyl]furan-2-yl]-10,11,12a-tris(oxidanyl)-4a,5,5a,6-tetrahydro-4H-tetracene-1,3,12-trione
MOLECULAR FORMULA: C30H36N4O8
MOLECULAR WEIGHT: 580.62884
SMILES: CN(C)CCNCC1=CC=C(O1)C2=C3C[C@H]4C[C@H]5[C@@H](C(=O)/C(=C(\N)/O)/C(=O)[C@]5(C(=O)C4=C(C3=C(C=C2)O)O)O)N(C)C
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Product OPENEYE NAME: 1-(2,4-difluorophenyl)-6-fluoro-7-[(3S)-3-methyl-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazin-7-yl]-4-oxo-1,8-naphthyridine-3-carboxylic acid
CAS Name: 1-(2,4-difluorophenyl)-6-fluoro-7-[(3S)-3-methyl-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazin-7-yl]-4-oxo-1,8-naphthyridine-3-carboxylic acid
IUPAC NAME: 1-(2,4-difluorophenyl)-6-fluoro-7-[(3S)-3-methyl-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazin-7-yl]-4-oxo-1,8-naphthyridine-3-carboxylic acid
SYSTEMATIC NAME: 1-[2,4-bis(fluoranyl)phenyl]-6-fluoranyl-7-[(3S)-3-methyl-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazin-7-yl]-4-oxidanylidene-1,8-naphthyridine-3-carboxylic acid
MOLECULAR FORMULA: C23H17F3N4O3
MOLECULAR WEIGHT: 454.40129
SMILES: C[C@H]1CN2C=C(C=C2CN1)C3=C(C=C4C(=O)C(=CN(C4=N3)C5=C(C=C(C=C5)F)F)C(=O)O)F
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Product OPENEYE NAME: 1-(2,4-difluorophenyl)-6-fluoro-7-[(1S)-1-methyl-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazin-7-yl]-4-oxo-1,8-naphthyridine-3-carboxylic acid
CAS Name: 1-(2,4-difluorophenyl)-6-fluoro-7-[(1S)-1-methyl-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazin-7-yl]-4-oxo-1,8-naphthyridine-3-carboxylic acid
IUPAC NAME: 1-(2,4-difluorophenyl)-6-fluoro-7-[(1S)-1-methyl-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazin-7-yl]-4-oxo-1,8-naphthyridine-3-carboxylic acid
SYSTEMATIC NAME: 1-[2,4-bis(fluoranyl)phenyl]-6-fluoranyl-7-[(1S)-1-methyl-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazin-7-yl]-4-oxidanylidene-1,8-naphthyridine-3-carboxylic acid
MOLECULAR FORMULA: C23H17F3N4O3
MOLECULAR WEIGHT: 454.40129
SMILES: C[C@H]1C2=CC(=CN2CCN1)C3=C(C=C4C(=O)C(=CN(C4=N3)C5=C(C=C(C=C5)F)F)C(=O)O)F
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Product OPENEYE NAME: 1-cyclopropyl-8-(difluoromethoxy)-6-fluoro-7-[(1S)-1-methyl-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazin-7-yl]-4-oxo-quinoline-3-carboxylic acid
CAS Name: 1-cyclopropyl-8-(difluoromethoxy)-6-fluoro-7-[(1S)-1-methyl-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazin-7-yl]-4-oxo-3-quinolinecarboxylic acid
IUPAC NAME: 1-cyclopropyl-8-(difluoromethoxy)-6-fluoro-7-[(1S)-1-methyl-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazin-7-yl]-4-oxoquinoline-3-carboxylic acid
SYSTEMATIC NAME: 8-[bis(fluoranyl)methoxy]-1-cyclopropyl-6-fluoranyl-7-[(1S)-1-methyl-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazin-7-yl]-4-oxidanylidene-quinoline-3-carboxylic acid
MOLECULAR FORMULA: C22H20F3N3O4
MOLECULAR WEIGHT: 447.40711
SMILES: C[C@H]1C2=CC(=CN2CCN1)C3=C(C=C4C(=C3OC(F)F)N(C=C(C4=O)C(=O)O)C5CC5)F
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Product OPENEYE NAME: 7-(2-benzyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-7-yl)-1-(2,4-difluorophenyl)-6-fluoro-4-oxo-1,8-naphthyridine-3-carboxylic acid
CAS Name: 1-(2,4-difluorophenyl)-6-fluoro-4-oxo-7-[2-(phenylmethyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-7-yl]-1,8-naphthyridine-3-carboxylic acid
IUPAC NAME: 7-(2-benzyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-7-yl)-1-(2,4-difluorophenyl)-6-fluoro-4-oxo-1,8-naphthyridine-3-carboxylic acid
SYSTEMATIC NAME: 1-[2,4-bis(fluoranyl)phenyl]-6-fluoranyl-4-oxidanylidene-7-[2-(phenylmethyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-7-yl]-1,8-naphthyridine-3-carboxylic acid
MOLECULAR FORMULA: C29H21F3N4O3
MOLECULAR WEIGHT: 530.49725
SMILES: C1CN2C=C(C=C2CN1CC3=CC=CC=C3)C4=C(C=C5C(=O)C(=CN(C5=N4)C6=C(C=C(C=C6)F)F)C(=O)O)F
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Product OPENEYE NAME: 7-(2-benzyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-7-yl)-1-cyclopropyl-6-fluoro-8-methoxy-4-oxo-quinoline-3-carboxylic acid
CAS Name: 1-cyclopropyl-6-fluoro-8-methoxy-4-oxo-7-[2-(phenylmethyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-7-yl]-3-quinolinecarboxylic acid
IUPAC NAME: 7-(2-benzyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-7-yl)-1-cyclopropyl-6-fluoro-8-methoxy-4-oxoquinoline-3-carboxylic acid
SYSTEMATIC NAME: 1-cyclopropyl-6-fluoranyl-8-methoxy-4-oxidanylidene-7-[2-(phenylmethyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-7-yl]quinoline-3-carboxylic acid
MOLECULAR FORMULA: C28H26FN3O4
MOLECULAR WEIGHT: 487.522143
SMILES: COC1=C2C(=CC(=C1C3=CN4CCN(CC4=C3)CC5=CC=CC=C5)F)C(=O)C(=CN2C6CC6)C(=O)O
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Product OPENEYE NAME: 4-[3-[(2-allylphenoxy)methyl]-1H-1,2,4-triazin-6-ylidene]-2,6-dibromo-cyclohexa-2,5-dien-1-one
CAS Name: 2,6-dibromo-4-[3-[(2-prop-2-enylphenoxy)methyl]-1H-1,2,4-triazin-6-ylidene]-1-cyclohexa-2,5-dienone
IUPAC NAME: 2,6-dibromo-4-[3-[(2-prop-2-enylphenoxy)methyl]-1H-1,2,4-triazin-6-ylidene]cyclohexa-2,5-dien-1-one
SYSTEMATIC NAME: 2,6-bis(bromanyl)-4-[3-[(2-prop-2-enylphenoxy)methyl]-1H-1,2,4-triazin-6-ylidene]cyclohexa-2,5-dien-1-one
MOLECULAR FORMULA: C19H15Br2N3O2
MOLECULAR WEIGHT: 477.1493
SMILES: C=CCC1=CC=CC=C1OCC2=NNC(=C3C=C(C(=O)C(=C3)Br)Br)C=N2
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