CAS RN: 111244-32-7
CAS Name: (Z)-1-[4-(dimethylamino)phenyl]-2-phenylethene-1,2-dithiolate; nickel
OPENEYE Name: (Z)-1-[4-(dimethylamino)phenyl]-2-phenyl-ethene-1,2-dithiolate; nickel
IUPAC Name: (Z)-1-[4-(dimethylamino)phenyl]-2-phenylethene-1,2-dithiolate; nickel
SYSTEMATIC NAME: (Z)-1-[4-(dimethylamino)phenyl]-2-phenyl-ethene-1,2-dithiolate; nickel
MOLECULAR FORMULA: C32H30N2NiS4-4
MOLECULAR WEIGHT: 629.5474
SMILES: CN(C1=CC=C(C=C1)/C(=C(/[S-])\C2=CC=CC=C2)/[S-])C.CN(C1=CC=C(C=C1)/C(=C(/[S-])\C2=CC=CC=C2)/[S-])C.[Ni]
Structure:
CAS RN: 111244-33-8
CAS Name: (Z)-1-[4-(dimethylamino)phenyl]-2-phenylethene-1,2-dithiolate; nickel
OPENEYE Name: (Z)-1-[4-(dimethylamino)phenyl]-2-phenyl-ethene-1,2-dithiolate; nickel
IUPAC Name: (Z)-1-[4-(dimethylamino)phenyl]-2-phenylethene-1,2-dithiolate; nickel
SYSTEMATIC NAME: (Z)-1-[4-(dimethylamino)phenyl]-2-phenyl-ethene-1,2-dithiolate; nickel
MOLECULAR FORMULA: C32H30N2NiS4-4
MOLECULAR WEIGHT: 629.5474
SMILES: CN(C1=CC=C(C=C1)/C(=C(/[S-])\C2=CC=CC=C2)/[S-])C.CN(C1=CC=C(C=C1)/C(=C(/[S-])\C2=CC=CC=C2)/[S-])C.[Ni]
Structure:
CAS RN: 190274-09-0
CAS Name: (Z)-1-[4-(dimethylamino)phenyl]-2-phenylethene-1,2-dithiolate; nickel
OPENEYE Name: (Z)-1-[4-(dimethylamino)phenyl]-2-phenyl-ethene-1,2-dithiolate; nickel
IUPAC Name: (Z)-1-[4-(dimethylamino)phenyl]-2-phenylethene-1,2-dithiolate; nickel
SYSTEMATIC NAME: (Z)-1-[4-(dimethylamino)phenyl]-2-phenyl-ethene-1,2-dithiolate; nickel
MOLECULAR FORMULA: C32H30N2NiS4-4
MOLECULAR WEIGHT: 629.5474
SMILES: CN(C1=CC=C(C=C1)/C(=C(/[S-])\C2=CC=CC=C2)/[S-])C.CN(C1=CC=C(C=C1)/C(=C(/[S-])\C2=CC=CC=C2)/[S-])C.[Ni]
Structure:
CAS RN: 38465-55-3
CAS Name: (Z)-1-[4-(dimethylamino)phenyl]-2-phenylethene-1,2-dithiolate; nickel
OPENEYE Name: (Z)-1-[4-(dimethylamino)phenyl]-2-phenyl-ethene-1,2-dithiolate; nickel
IUPAC Name: (Z)-1-[4-(dimethylamino)phenyl]-2-phenylethene-1,2-dithiolate; nickel
SYSTEMATIC NAME: (Z)-1-[4-(dimethylamino)phenyl]-2-phenyl-ethene-1,2-dithiolate; nickel
MOLECULAR FORMULA: C32H30N2NiS4-4
MOLECULAR WEIGHT: 629.5474
SMILES: CN(C1=CC=C(C=C1)/C(=C(/[S-])\C2=CC=CC=C2)/[S-])C.CN(C1=CC=C(C=C1)/C(=C(/[S-])\C2=CC=CC=C2)/[S-])C.[Ni]
Structure:
CAS RN: 75433-34-0
CAS Name: (Z)-1-[4-(dimethylamino)phenyl]-2-phenylethene-1,2-dithiolate; nickel
OPENEYE Name: (Z)-1-[4-(dimethylamino)phenyl]-2-phenyl-ethene-1,2-dithiolate; nickel
IUPAC Name: (Z)-1-[4-(dimethylamino)phenyl]-2-phenylethene-1,2-dithiolate; nickel
SYSTEMATIC NAME: (Z)-1-[4-(dimethylamino)phenyl]-2-phenyl-ethene-1,2-dithiolate; nickel
MOLECULAR FORMULA: C32H30N2NiS4-4
MOLECULAR WEIGHT: 629.5474
SMILES: CN(C1=CC=C(C=C1)/C(=C(/[S-])\C2=CC=CC=C2)/[S-])C.CN(C1=CC=C(C=C1)/C(=C(/[S-])\C2=CC=CC=C2)/[S-])C.[Ni]
Structure:
CAS RN: 67298-15-1
CAS Name: 2-[[(2S,3R,4R,5S,6R)-5-[[(2S,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-methoxy-2-oxanyl]oxy]-3,4-dihydroxy-6-methyl-2-oxanyl]amino]-4-methoxy-7H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile
OPENEYE Name: 2-[[(2S,3R,4R,5S,6R)-5-[(2S,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-methoxy-tetrahydropyran-2-yl]oxy-3,4-dihydroxy-6-methyl-tetrahydropyran-2-yl]amino]-4-methoxy-7H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile
IUPAC Name: 2-[[(2S,3R,4R,5S,6R)-5-[(2S,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-methoxyoxan-2-yl]oxy-3,4-dihydroxy-6-methyloxan-2-yl]amino]-4-methoxy-7H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile
SYSTEMATIC NAME: 2-[[(2S,3R,4R,5S,6R)-5-[(2S,3R,4R,5S,6R)-6-(hydroxymethyl)-5-methoxy-3,4-bis(oxidanyl)oxan-2-yl]oxy-6-methyl-3,4-bis(oxidanyl)oxan-2-yl]amino]-4-methoxy-7H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile
MOLECULAR FORMULA: C21H29N5O10
MOLECULAR WEIGHT: 511.48246
SMILES: C[C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)NC2=NC3=C(C(=CN3)C#N)C(=N2)OC)O)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)OC)O)O
Structure:
CAS RN: 64683-40-5
CAS Name: (3Z)-7-amino-4-oxo-3-[[4-(4-sulfophenyl)azophenyl]hydrazinylidene]-2-naphthalenesulfonic acid; 2-[bis(2-hydroxyethyl)amino]ethanol
OPENEYE Name: (3Z)-7-amino-4-oxo-3-[[4-(4-sulfophenyl)azophenyl]hydrazono]naphthalene-2-sulfonic acid; 2-[bis(2-hydroxyethyl)amino]ethanol
IUPAC Name: (3Z)-7-amino-4-oxo-3-[[4-[(4-sulfophenyl)diazenyl]phenyl]hydrazinylidene]naphthalene-2-sulfonic acid; 2-[bis(2-hydroxyethyl)amino]ethanol
SYSTEMATIC NAME: (3Z)-7-azanyl-4-oxidanylidene-3-[[4-[(4-sulfophenyl)diazenyl]phenyl]hydrazinylidene]naphthalene-2-sulfonic acid; 2-[bis(2-hydroxyethyl)amino]ethanol
MOLECULAR FORMULA: C34H47N7O13S2
MOLECULAR WEIGHT: 825.90608
SMILES: C1=CC(=CC=C1N/N=C/2\C(=CC3=C(C2=O)C=CC(=C3)N)S(=O)(=O)O)N=NC4=CC=C(C=C4)S(=O)(=O)O.C(CO)N(CCO)CCO.C(CO)N(CCO)CCO
Structure:
CAS RN: 70466-83-0
CAS Name: (3Z)-5-acetyl-3-[1-(3-amino-4-hydroxyanilino)ethylidene]-6-hydroxypyran-2,4-dione
OPENEYE Name: (3Z)-5-acetyl-3-[1-(3-amino-4-hydroxy-anilino)ethylidene]-6-hydroxy-pyran-2,4-dione
IUPAC Name: (3Z)-5-acetyl-3-[1-(3-amino-4-hydroxyanilino)ethylidene]-6-hydroxypyran-2,4-dione
SYSTEMATIC NAME: (3Z)-3-[1-[(3-azanyl-4-oxidanyl-phenyl)amino]ethylidene]-5-ethanoyl-6-oxidanyl-pyran-2,4-dione
MOLECULAR FORMULA: C15H14N2O6
MOLECULAR WEIGHT: 318.28146
SMILES: CC(=O)C1=C(OC(=O)/C(=C(/C)\NC2=CC(=C(C=C2)O)N)/C1=O)O
Structure:
CAS RN: 64353-91-9
CAS Name: (3Z)-5-acetyl-3-[1-(3-amino-4-hydroxyanilino)ethylidene]-6-hydroxypyran-2,4-dione hydrochloride
OPENEYE Name: (3Z)-5-acetyl-3-[1-(3-amino-4-hydroxy-anilino)ethylidene]-6-hydroxy-pyran-2,4-dione hydrochloride
IUPAC Name: (3Z)-5-acetyl-3-[1-(3-amino-4-hydroxyanilino)ethylidene]-6-hydroxypyran-2,4-dione hydrochloride
SYSTEMATIC NAME: (3Z)-3-[1-[(3-azanyl-4-oxidanyl-phenyl)amino]ethylidene]-5-ethanoyl-6-oxidanyl-pyran-2,4-dione hydrochloride
MOLECULAR FORMULA: C15H15ClN2O6
MOLECULAR WEIGHT: 354.7424
SMILES: CC(=O)C1=C(OC(=O)/C(=C(/C)\NC2=CC(=C(C=C2)O)N)/C1=O)O.Cl
Structure:
CAS RN: 59755-82-7
CAS Name: (4E)-7-chloro-4-[(3,4-dichloroanilino)-hydroxymethylidene]-1,1-dioxo-2,3-dihydro-1$l^{6}-benzothiepin-5-one
OPENEYE Name: (4E)-7-chloro-4-[(3,4-dichloroanilino)-hydroxy-methylene]-1,1-dioxo-2,3-dihydro-1$l^{6}-benzothiepin-5-one
IUPAC Name: (4E)-7-chloro-4-[(3,4-dichloroanilino)-hydroxymethylidene]-1,1-dioxo-2,3-dihydro-1$l^{6}-benzothiepin-5-one
SYSTEMATIC NAME: (4E)-7-chloranyl-4-[[(3,4-dichlorophenyl)amino]-oxidanyl-methylidene]-1,1-bis(oxidanylidene)-2,3-dihydro-1$l^{6}-benzothiepin-5-one
MOLECULAR FORMULA: C17H12Cl3NO4S
MOLECULAR WEIGHT: 432.70548
SMILES: C\1CS(=O)(=O)C2=C(C=C(C=C2)Cl)C(=O)/C1=C(\NC3=CC(=C(C=C3)Cl)Cl)/O
Structure:
CAS RN: 57664-96-7
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C17H19NO4
MOLECULAR WEIGHT: 301.33706
SMILES: COC1=C2C3=C(C[C@@H]4[C@]5([C@]3(CCN4)[C@@H](O2)C(=O)CC5)O)C=C1
Structure:
CAS RN: 51419-48-8
CAS Name: 5,7-dihydroxy-2-[2-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-2,3-dihydro-1,4-benzodioxin-6-yl]-1-benzopyran-4-one
OPENEYE Name: 5,7-dihydroxy-2-[2-(4-hydroxy-3-methoxy-phenyl)-3-(hydroxymethyl)-2,3-dihydro-1,4-benzodioxin-6-yl]chromen-4-one
IUPAC Name: 5,7-dihydroxy-2-[2-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-2,3-dihydro-1,4-benzodioxin-6-yl]chromen-4-one
SYSTEMATIC NAME: 2-[3-(hydroxymethyl)-2-(3-methoxy-4-oxidanyl-phenyl)-2,3-dihydro-1,4-benzodioxin-6-yl]-5,7-bis(oxidanyl)chromen-4-one
MOLECULAR FORMULA: C25H20O9
MOLECULAR WEIGHT: 464.4209
SMILES: COC1=C(C=CC(=C1)C2C(OC3=C(O2)C=CC(=C3)C4=CC(=O)C5=C(C=C(C=C5O4)O)O)CO)O
Structure:
CAS RN: 40603-58-5
CAS Name: zinc 5,10,15-tris(1-methyl-4-pyridin-1-iumyl)-20-(1-methyl-4-pyridinylidene)porphyrin-22-ide
OPENEYE Name: zinc 5,10,15-tris(1-methylpyridin-1-ium-4-yl)-20-(1-methyl-4-pyridylidene)porphyrin-22-ide
IUPAC Name: zinc 5,10,15-tris(1-methylpyridin-1-ium-4-yl)-20-(1-methylpyridin-4-ylidene)porphyrin-22-ide
SYSTEMATIC NAME: zinc 5,10,15-tris(1-methylpyridin-1-ium-4-yl)-20-(1-methylpyridin-4-ylidene)porphyrin-22-ide
MOLECULAR FORMULA: C44H36N8Zn+4
MOLECULAR WEIGHT: 742.21924
SMILES: CN1C=CC(=C2C3=NC(=C(C4=NC(=C(C5=CC=C([N-]5)C(=C6C=CC2=N6)C7=CC=[N+](C=C7)C)C8=CC=[N+](C=C8)C)C=C4)C9=CC=[N+](C=C9)C)C=C3)C=C1.[Zn+2]
Structure:
CAS RN: 37106-99-3
CAS Name: (2S)-1-[[[(E)-[(4R,4aR,5aR,6S,12aR)-4-(dimethylamino)-6,10,11,12a-tetrahydroxy-6-methyl-1,3,12-trioxo-4,4a,5,5a-tetrahydrotetracen-2-ylidene]-hydroxymethyl]amino]methyl]-2-pyrrolidinecarboxylic acid
OPENEYE Name: (2S)-1-[[[(E)-[(4R,4aR,5aR,6S,12aR)-4-(dimethylamino)-6,10,11,12a-tetrahydroxy-6-methyl-1,3,12-trioxo-4,4a,5,5a-tetrahydrotetracen-2-ylidene]-hydroxy-methyl]amino]methyl]pyrrolidine-2-carboxylic acid
IUPAC Name: (2S)-1-[[[(E)-[(4R,4aR,5aR,6S,12aR)-4-(dimethylamino)-6,10,11,12a-tetrahydroxy-6-methyl-1,3,12-trioxo-4,4a,5,5a-tetrahydrotetracen-2-ylidene]-hydroxymethyl]amino]methyl]pyrrolidine-2-carboxylic acid
SYSTEMATIC NAME: (2S)-1-[[[(E)-[(4R,4aR,5aR,6S,12aR)-4-(dimethylamino)-6-methyl-6,10,11,12a-tetrakis(oxidanyl)-1,3,12-tris(oxidanylidene)-4,4a,5,5a-tetrahydrotetracen-2-ylidene]-oxidanyl-methyl]amino]methyl]pyrrolidine-2-carboxylic acid
MOLECULAR FORMULA: C28H33N3O10
MOLECULAR WEIGHT: 571.57572
SMILES: C[C@@]1([C@@H]2C[C@@H]3[C@H](C(=O)/C(=C(/NCN4CCC[C@H]4C(=O)O)\O)/C(=O)[C@@]3(C(=O)C2=C(C5=C1C=CC=C5O)O)O)N(C)C)O
Structure:
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