CAS RN: 64884-14-6
CAS Name: cyclopenta-1,3-diene; (E)-1-(1-cyclopenta-2,4-dienyl)-3-phenyl-2-propen-1-one; ruthenium
OPENEYE Name: cyclopenta-1,3-diene; (E)-1-cyclopenta-2,4-dien-1-yl-3-phenyl-prop-2-en-1-one; ruthenium
IUPAC Name: cyclopenta-1,3-diene; (E)-1-cyclopenta-2,4-dien-1-yl-3-phenylprop-2-en-1-one; ruthenium
SYSTEMATIC NAME: cyclopenta-1,3-diene; (E)-1-cyclopenta-2,4-dien-1-yl-3-phenyl-prop-2-en-1-one; ruthenium
MOLECULAR FORMULA: C19H16ORu-2
MOLECULAR WEIGHT: 361.39974
SMILES: [CH-]1C=CC=C1.C1=CC=C(C=C1)/C=C/C(=O)[C-]2C=CC=C2.[Ru]
Structure:
CAS RN: 12277-55-3
CAS Name: cyclopenta-1,3-diene; 2-(1-cyclopenta-2,4-dienyl)-3-isothiocyanatobenzoic acid; iron
OPENEYE Name: cyclopenta-1,3-diene; 2-cyclopenta-2,4-dien-1-yl-3-isothiocyanato-benzoic acid; iron
IUPAC Name: cyclopenta-1,3-diene; 2-cyclopenta-2,4-dien-1-yl-3-isothiocyanatobenzoic acid; iron
SYSTEMATIC NAME: cyclopenta-1,3-diene; 2-cyclopenta-2,4-dien-1-yl-3-isothiocyanato-benzoic acid; iron
MOLECULAR FORMULA: C18H13FeNO2S-2
MOLECULAR WEIGHT: 363.21132
SMILES: [CH-]1C=CC=C1.C1=C[C-](C=C1)C2=C(C=CC=C2N=C=S)C(=O)O.[Fe]
Structure:
CAS RN: 67527-18-8
CAS Name: cyclopenta-1,3-diene; 1-(1-cyclopenta-2,4-dienyl)-3,5,5-trimethyl-1-hexanone; iron
OPENEYE Name: cyclopenta-1,3-diene; 1-cyclopenta-2,4-dien-1-yl-3,5,5-trimethyl-hexan-1-one; iron
IUPAC Name: cyclopenta-1,3-diene; 1-cyclopenta-2,4-dien-1-yl-3,5,5-trimethylhexan-1-one; iron
SYSTEMATIC NAME: cyclopenta-1,3-diene; 1-cyclopenta-2,4-dien-1-yl-3,5,5-trimethyl-hexan-1-one; iron
MOLECULAR FORMULA: C19H26FeO-2
MOLECULAR WEIGHT: 326.25414
SMILES: CC(CC(=O)[C-]1C=CC=C1)CC(C)(C)C.[CH-]1C=CC=C1.[Fe]
Structure:
CAS RN: 634-62-8
CAS Name: 2,3-dihydroxybutanedioate; hydrazine
OPENEYE Name: 2,3-dihydroxybutanedioate; hydrazine
IUPAC Name: 2,3-dihydroxybutanedioate; hydrazine
SYSTEMATIC NAME: 2,3-bis(oxidanyl)butanedioate; diazane
MOLECULAR FORMULA: C4H8N2O6-2
MOLECULAR WEIGHT: 180.11612
SMILES: C(C(C(=O)[O-])O)(C(=O)[O-])O.NN
Structure:
CAS RN: 29169-26-4
CAS Name: 2,3-dihydroxybutanedioate; hydrazine
OPENEYE Name: 2,3-dihydroxybutanedioate; hydrazine
IUPAC Name: 2,3-dihydroxybutanedioate; hydrazine
SYSTEMATIC NAME: 2,3-bis(oxidanyl)butanedioate; diazane
MOLECULAR FORMULA: C4H8N2O6-2
MOLECULAR WEIGHT: 180.11612
SMILES: C(C(C(=O)[O-])O)(C(=O)[O-])O.NN
Structure:
CAS RN: 5936-33-4
CAS Name: 2,3-dihydroxybutanedioate; hydrazine
OPENEYE Name: 2,3-dihydroxybutanedioate; hydrazine
IUPAC Name: 2,3-dihydroxybutanedioate; hydrazine
SYSTEMATIC NAME: 2,3-bis(oxidanyl)butanedioate; diazane
MOLECULAR FORMULA: C4H8N2O6-2
MOLECULAR WEIGHT: 180.11612
SMILES: C(C(C(=O)[O-])O)(C(=O)[O-])O.NN
Structure:
CAS RN: 51862-24-9
CAS Name: 2-chloro-1-(1-cyclopenta-2,4-dienyl)ethanone; cyclopenta-1,3-diene; iron
OPENEYE Name: 2-chloro-1-cyclopenta-2,4-dien-1-yl-ethanone; cyclopenta-1,3-diene; iron
IUPAC Name: 2-chloro-1-cyclopenta-2,4-dien-1-ylethanone; cyclopenta-1,3-diene; iron
SYSTEMATIC NAME: 2-chloranyl-1-cyclopenta-2,4-dien-1-yl-ethanone; cyclopenta-1,3-diene; iron
MOLECULAR FORMULA: C12H11ClFeO-2
MOLECULAR WEIGHT: 262.51314
SMILES: [CH-]1C=CC=C1.C1=C[C-](C=C1)C(=O)CCl.[Fe]
Structure:
CAS RN: 42830-80-8
CAS Name: cyclopenta-1,3-diene; 1-(1-cyclopenta-2,4-dienyl)-2-propanamine; iron
OPENEYE Name: cyclopenta-1,3-diene; 1-cyclopenta-2,4-dien-1-ylpropan-2-amine; iron
IUPAC Name: cyclopenta-1,3-diene; 1-cyclopenta-2,4-dien-1-ylpropan-2-amine; iron
SYSTEMATIC NAME: cyclopenta-1,3-diene; 1-cyclopenta-2,4-dien-1-ylpropan-2-amine; iron
MOLECULAR FORMULA: C13H17FeN-2
MOLECULAR WEIGHT: 243.12578
SMILES: CC(C[C-]1C=CC=C1)N.[CH-]1C=CC=C1.[Fe]
Structure:
CAS RN: 28033-08-1
CAS Name: 3-amino-6-bromo-2-pyridinecarboxylic acid ethyl ester
OPENEYE Name: ethyl 3-amino-6-bromo-pyridine-2-carboxylate
IUPAC Name: ethyl 3-amino-6-bromopyridine-2-carboxylate
SYSTEMATIC NAME: ethyl 3-azanyl-6-bromanyl-pyridine-2-carboxylate
MOLECULAR FORMULA: C8H9BrN2O2
MOLECULAR WEIGHT: 245.07326
SMILES: CCOC(=O)C1=C(C=CC(=N1)Br)N
Structure:
CAS RN: 458543-81-2
CAS Name: 3-amino-2,6-dichloro-4-pyridinecarboxylic acid ethyl ester
OPENEYE Name: ethyl 3-amino-2,6-dichloro-pyridine-4-carboxylate
IUPAC Name: ethyl 3-amino-2,6-dichloropyridine-4-carboxylate
SYSTEMATIC NAME: ethyl 3-azanyl-2,6-bis(chloranyl)pyridine-4-carboxylate
MOLECULAR FORMULA: C8H8Cl2N2O2
MOLECULAR WEIGHT: 235.06732
SMILES: CCOC(=O)C1=CC(=NC(=C1N)Cl)Cl
Structure:
CAS RN: 98130-70-2
CAS Name: 3,4-dichloro-1H-pyrrole-2,5-dicarboxylic acid
OPENEYE Name: 3,4-dichloro-1H-pyrrole-2,5-dicarboxylic acid
IUPAC Name: 3,4-dichloro-1H-pyrrole-2,5-dicarboxylic acid
SYSTEMATIC NAME: 3,4-bis(chloranyl)-1H-pyrrole-2,5-dicarboxylic acid
MOLECULAR FORMULA: C6H3Cl2NO4
MOLECULAR WEIGHT: 223.99832
SMILES: C1(=C(NC(=C1Cl)C(=O)O)C(=O)O)Cl
Structure:
CAS RN: 848499-70-7
CAS Name: 3,4-dichloro-5-cyano-1H-pyrrole-2-carboxylic acid
OPENEYE Name: 3,4-dichloro-5-cyano-1H-pyrrole-2-carboxylic acid
IUPAC Name: 3,4-dichloro-5-cyano-1H-pyrrole-2-carboxylic acid
SYSTEMATIC NAME: 3,4-bis(chloranyl)-5-cyano-1H-pyrrole-2-carboxylic acid
MOLECULAR FORMULA: C6H2Cl2N2O2
MOLECULAR WEIGHT: 204.99828
SMILES: C(#N)C1=C(C(=C(N1)C(=O)O)Cl)Cl
Structure:
CAS RN: 24691-30-3
CAS Name: 3,4-dichloro-5-methyl-1H-pyrrole-2-carboxylic acid
OPENEYE Name: 3,4-dichloro-5-methyl-1H-pyrrole-2-carboxylic acid
IUPAC Name: 3,4-dichloro-5-methyl-1H-pyrrole-2-carboxylic acid
SYSTEMATIC NAME: 3,4-bis(chloranyl)-5-methyl-1H-pyrrole-2-carboxylic acid
MOLECULAR FORMULA: C6H5Cl2NO2
MOLECULAR WEIGHT: 194.0154
SMILES: CC1=C(C(=C(N1)C(=O)O)Cl)Cl
Structure:
CAS RN: 98886-44-3
CAS Name: 3-[[[(2S)-butan-2-yl]thio]-ethoxyphosphoryl]-2-thiazolidinone
OPENEYE Name: 3-[ethoxy-[(1S)-1-methylpropyl]sulfanyl-phosphoryl]thiazolidin-2-one
IUPAC Name: 3-[[(2S)-butan-2-yl]sulfanyl-ethoxyphosphoryl]-1,3-thiazolidin-2-one
SYSTEMATIC NAME: 3-[[(2S)-butan-2-yl]sulfanyl-ethoxy-phosphoryl]-1,3-thiazolidin-2-one
MOLECULAR FORMULA: C9H18NO3PS2
MOLECULAR WEIGHT: 283.347881
SMILES: CC[C@H](C)S[P@](=O)(N1CCSC1=O)OCC
Structure:
CAS RN: 119738-06-6
CAS Name: (2R)-2-[4-[(6-chloro-2-quinoxalinyl)oxy]phenoxy]propanoic acid [(2S)-2-oxolanyl]methyl ester
OPENEYE Name: [(2S)-tetrahydrofuran-2-yl]methyl (2R)-2-[4-(6-chloroquinoxalin-2-yl)oxyphenoxy]propanoate
IUPAC Name: [(2S)-oxolan-2-yl]methyl (2R)-2-[4-(6-chloroquinoxalin-2-yl)oxyphenoxy]propanoate
SYSTEMATIC NAME: [(2S)-oxolan-2-yl]methyl (2R)-2-[4-(6-chloranylquinoxalin-2-yl)oxyphenoxy]propanoate
MOLECULAR FORMULA: C22H21ClN2O5
MOLECULAR WEIGHT: 428.86554
SMILES: C[C@H](C(=O)OC[C@@H]1CCCO1)OC2=CC=C(C=C2)OC3=CN=C4C=C(C=CC4=N3)Cl
Structure:
CAS RN: 87818-31-3
CAS Name: (1R,2R,4S)-1-methyl-2-[(2-methylphenyl)methoxy]-4-propan-2-yl-7-oxabicyclo[2.2.1]heptane
OPENEYE Name: (1R,2R,4S)-4-isopropyl-1-methyl-2-(o-tolylmethoxy)-7-oxabicyclo[2.2.1]heptane
IUPAC Name: (1R,2R,4S)-1-methyl-2-[(2-methylphenyl)methoxy]-4-propan-2-yl-7-oxabicyclo[2.2.1]heptane
SYSTEMATIC NAME: (1R,2R,4S)-1-methyl-2-[(2-methylphenyl)methoxy]-4-propan-2-yl-7-oxabicyclo[2.2.1]heptane
MOLECULAR FORMULA: C18H26O2
MOLECULAR WEIGHT: 274.39784
SMILES: CC1=CC=CC=C1CO[C@@H]2C[C@@]3(CC[C@]2(O3)C)C(C)C
Structure:
CAS RN: 649551-98-4
CAS Name: (E)-1-(2-hydroxy-3-prop-2-enylphenyl)-3-(2,4,5-trimethoxyphenyl)-2-propen-1-one
OPENEYE Name: (E)-1-(3-allyl-2-hydroxy-phenyl)-3-(2,4,5-trimethoxyphenyl)prop-2-en-1-one
IUPAC Name: (E)-1-(2-hydroxy-3-prop-2-enylphenyl)-3-(2,4,5-trimethoxyphenyl)prop-2-en-1-one
SYSTEMATIC NAME: (E)-1-(2-oxidanyl-3-prop-2-enyl-phenyl)-3-(2,4,5-trimethoxyphenyl)prop-2-en-1-one
MOLECULAR FORMULA: C21H22O5
MOLECULAR WEIGHT: 354.39638
SMILES: COC1=CC(=C(C=C1/C=C/C(=O)C2=C(C(=CC=C2)CC=C)O)OC)OC
Structure:
CAS RN: 649551-69-9
CAS Name: (E)-1-(2-hydroxy-4-iodophenyl)-3-(3,4,5-trimethoxyphenyl)-2-propen-1-one
OPENEYE Name: (E)-1-(2-hydroxy-4-iodo-phenyl)-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one
IUPAC Name: (E)-1-(2-hydroxy-4-iodophenyl)-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one
SYSTEMATIC NAME: (E)-1-(4-iodanyl-2-oxidanyl-phenyl)-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one
MOLECULAR FORMULA: C18H17IO5
MOLECULAR WEIGHT: 440.22905
SMILES: COC1=CC(=CC(=C1OC)OC)/C=C/C(=O)C2=C(C=C(C=C2)I)O
Structure:
CAS RN: 443891-20-1
CAS Name: (Z)-3-(6-methyl-3-quinolinyl)-2-propenoic acid methyl ester
OPENEYE Name: methyl (Z)-3-(6-methyl-3-quinolyl)prop-2-enoate
IUPAC Name: methyl (Z)-3-(6-methylquinolin-3-yl)prop-2-enoate
SYSTEMATIC NAME: methyl (Z)-3-(6-methylquinolin-3-yl)prop-2-enoate
MOLECULAR FORMULA: C14H13NO2
MOLECULAR WEIGHT: 227.25852
SMILES: CC1=CC2=CC(=CN=C2C=C1)/C=C\C(=O)OC
Structure:
CAS RN: 866621-28-5
CAS Name: (Z)-3-(2-methyl-6-quinolinyl)-2-propenoic acid methyl ester
OPENEYE Name: methyl (Z)-3-(2-methyl-6-quinolyl)prop-2-enoate
IUPAC Name: methyl (Z)-3-(2-methylquinolin-6-yl)prop-2-enoate
SYSTEMATIC NAME: methyl (Z)-3-(2-methylquinolin-6-yl)prop-2-enoate
MOLECULAR FORMULA: C14H13NO2
MOLECULAR WEIGHT: 227.25852
SMILES: CC1=NC2=C(C=C1)C=C(C=C2)/C=C\C(=O)OC
Structure:
CAS RN: 866621-27-4
CAS Name: (E)-3-(3,5-dimethyl-4-isoxazolyl)-2-propenoic acid methyl ester
OPENEYE Name: methyl (E)-3-(3,5-dimethylisoxazol-4-yl)prop-2-enoate
IUPAC Name: methyl (E)-3-(3,5-dimethyl-1,2-oxazol-4-yl)prop-2-enoate
SYSTEMATIC NAME: methyl (E)-3-(3,5-dimethyl-1,2-oxazol-4-yl)prop-2-enoate
MOLECULAR FORMULA: C9H11NO3
MOLECULAR WEIGHT: 181.18854
SMILES: CC1=C(C(=NO1)C)/C=C/C(=O)OC
Structure:
CAS RN: 866621-26-3
CAS Name: (E)-3-(1-acetyl-3,5-dimethyl-4-pyrazolyl)-2-propenoic acid methyl ester
OPENEYE Name: methyl (E)-3-(1-acetyl-3,5-dimethyl-pyrazol-4-yl)prop-2-enoate
IUPAC Name: methyl (E)-3-(1-acetyl-3,5-dimethylpyrazol-4-yl)prop-2-enoate
SYSTEMATIC NAME: methyl (E)-3-(1-ethanoyl-3,5-dimethyl-pyrazol-4-yl)prop-2-enoate
MOLECULAR FORMULA: C11H14N2O3
MOLECULAR WEIGHT: 222.24046
SMILES: CC1=C(C(=NN1C(=O)C)C)/C=C/C(=O)OC
Structure:
CAS RN: 154844-41-4
CAS Name: (E)-3-(5-pyrimidinyl)-2-propenoic acid tert-butyl ester
OPENEYE Name: tert-butyl (E)-3-pyrimidin-5-ylprop-2-enoate
IUPAC Name: tert-butyl (E)-3-pyrimidin-5-ylprop-2-enoate
SYSTEMATIC NAME: tert-butyl (E)-3-pyrimidin-5-ylprop-2-enoate
MOLECULAR FORMULA: C11H14N2O2
MOLECULAR WEIGHT: 206.24106
SMILES: CC(C)(C)OC(=O)/C=C/C1=CN=CN=C1
Structure:
CAS RN: 866621-25-2
CAS Name: (E)-3-(1-acetyl-4-pyrazolyl)-2-propenoic acid methyl ester
OPENEYE Name: methyl (E)-3-(1-acetylpyrazol-4-yl)prop-2-enoate
IUPAC Name: methyl (E)-3-(1-acetylpyrazol-4-yl)prop-2-enoate
SYSTEMATIC NAME: methyl (E)-3-(1-ethanoylpyrazol-4-yl)prop-2-enoate
MOLECULAR FORMULA: C9H10N2O3
MOLECULAR WEIGHT: 194.1873
SMILES: CC(=O)N1C=C(C=N1)/C=C/C(=O)OC
Structure:
CAS RN: 1089736-73-1
CAS Name: (2S)-3-methyl-2-[(2,2,3,3,4,4,5,5,5-nonadeuterio-1-oxopentyl)-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]amino]butanoic acid
OPENEYE Name: (2S)-3-methyl-2-[2,2,3,3,4,4,5,5,5-nonadeuteriopentanoyl-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]amino]butanoic acid
IUPAC Name: (2S)-3-methyl-2-[2,2,3,3,4,4,5,5,5-nonadeuteriopentanoyl-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]amino]butanoic acid
SYSTEMATIC NAME: (2S)-3-methyl-2-[2,2,3,3,4,4,5,5,5-nonadeuteriopentanoyl-[[4-[2-(2H-1,2,3,4-tetrazol-5-yl)phenyl]phenyl]methyl]amino]butanoic acid
MOLECULAR FORMULA: C24H29N5O3
MOLECULAR WEIGHT: 444.574216
SMILES: [2H]C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C(=O)N(CC1=CC=C(C=C1)C2=CC=CC=C2C3=NNN=N3)[C@@H](C(C)C)C(=O)O
Structure:
CAS RN: 505082-81-5
CAS Name: 4-(3,4-difluorophenyl)benzoic acid
OPENEYE Name: 4-(3,4-difluorophenyl)benzoic acid
IUPAC Name: 4-(3,4-difluorophenyl)benzoic acid
SYSTEMATIC NAME: 4-[3,4-bis(fluoranyl)phenyl]benzoic acid
MOLECULAR FORMULA: C13H8F2O2
MOLECULAR WEIGHT: 234.198226
SMILES: C1=CC(=CC=C1C2=CC(=C(C=C2)F)F)C(=O)O
Structure:
CAS RN: 1217720-14-3
CAS Name: [(2R)-1-(6-aminopurin-9-yl)-1,1,2,3,3,3-hexadeuteriopropan-2-yl]oxymethylphosphonic acid
OPENEYE Name: [(1R)-1-[(6-aminopurin-9-yl)-dideuterio-methyl]-1,2,2,2-tetradeuterio-ethoxy]methylphosphonic acid
IUPAC Name: [(2R)-1-(6-aminopurin-9-yl)-1,1,2,3,3,3-hexadeuteriopropan-2-yl]oxymethylphosphonic acid
SYSTEMATIC NAME: [(2R)-1-(6-aminopurin-9-yl)-1,1,2,3,3,3-hexadeuterio-propan-2-yl]oxymethylphosphonic acid
MOLECULAR FORMULA: C9H14N5O4P
MOLECULAR WEIGHT: 293.249292
SMILES: [2H][C@@](C([2H])([2H])[2H])(C([2H])([2H])N1C=NC2=C1N=CN=C2N)OCP(=O)(O)O
Structure:
CAS RN: 106372-55-8
CAS Name: (3S)-3-amino-4-[[(2S)-1-methoxy-1-oxo-3-phenylpropan-2-yl]amino]-4-oxobutanoic acid; 6-methyl-2,2-dioxo-4-oxathiazinone
OPENEYE Name: (3S)-3-amino-4-[[(1S)-1-benzyl-2-methoxy-2-oxo-ethyl]amino]-4-oxo-butanoic acid; 6-methyl-2,2-dioxo-oxathiazin-4-one
IUPAC Name: (3S)-3-amino-4-[[(2S)-1-methoxy-1-oxo-3-phenylpropan-2-yl]amino]-4-oxobutanoic acid; 6-methyl-2,2-dioxooxathiazin-4-one
SYSTEMATIC NAME: (3S)-3-azanyl-4-[[(2S)-1-methoxy-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-4-oxidanylidene-butanoic acid; 6-methyl-2,2-bis(oxidanylidene)-1,2,3-oxathiazin-4-one
MOLECULAR FORMULA: C18H23N3O9S
MOLECULAR WEIGHT: 457.45492
SMILES: CC1=CC(=O)NS(=O)(=O)O1.COC(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@H](CC(=O)O)N
Structure:
CAS RN: 57372-70-0
CAS Name: (2S)-2-amino-3-(4-fluoro-1H-imidazol-5-yl)propanoic acid
OPENEYE Name: (2S)-2-amino-3-(4-fluoro-1H-imidazol-5-yl)propanoic acid
IUPAC Name: (2S)-2-amino-3-(4-fluoro-1H-imidazol-5-yl)propanoic acid
SYSTEMATIC NAME: (2S)-2-azanyl-3-(4-fluoranyl-1H-imidazol-5-yl)propanoic acid
MOLECULAR FORMULA: C6H8FN3O2
MOLECULAR WEIGHT: 173.145023
SMILES: C1=NC(=C(N1)C[C@@H](C(=O)O)N)F
Structure:
CAS RN: 1089283-49-7
CAS Name: N-(2,6-difluorophenyl)-5-[3-[2-[5-ethyl-2-methoxy-4-[4-(4-methylsulfonyl-1-piperazinyl)-1-piperidinyl]anilino]-4-pyrimidinyl]-2-imidazo[1,2-a]pyridinyl]-2-methoxybenzamide
OPENEYE Name: N-(2,6-difluorophenyl)-5-[3-[2-[5-ethyl-2-methoxy-4-[4-(4-methylsulfonylpiperazin-1-yl)-1-piperidyl]anilino]pyrimidin-4-yl]imidazo[1,2-a]pyridin-2-yl]-2-methoxy-benzamide
IUPAC Name: N-(2,6-difluorophenyl)-5-[3-[2-[5-ethyl-2-methoxy-4-[4-(4-methylsulfonylpiperazin-1-yl)piperidin-1-yl]anilino]pyrimidin-4-yl]imidazo[1,2-a]pyridin-2-yl]-2-methoxybenzamide
SYSTEMATIC NAME: N-[2,6-bis(fluoranyl)phenyl]-5-[3-[2-[[5-ethyl-2-methoxy-4-[4-(4-methylsulfonylpiperazin-1-yl)piperidin-1-yl]phenyl]amino]pyrimidin-4-yl]imidazo[1,2-a]pyridin-2-yl]-2-methoxy-benzamide
MOLECULAR FORMULA: C44H47F2N9O5S
MOLECULAR WEIGHT: 851.963086
SMILES: CCC1=CC(=C(C=C1N2CCC(CC2)N3CCN(CC3)S(=O)(=O)C)OC)NC4=NC=CC(=N4)C5=C(N=C6N5C=CC=C6)C7=CC(=C(C=C7)OC)C(=O)NC8=C(C=CC=C8F)F
Structure:
CAS RN: 629662-20-0
CAS Name: 1,1-dimethyl-3,6-dihydro-2H-azepino[4,5-b]indole-5-carboxylic acid ethyl ester
OPENEYE Name: ethyl 1,1-dimethyl-3,6-dihydro-2H-azepino[4,5-b]indole-5-carboxylate
IUPAC Name: ethyl 1,1-dimethyl-3,6-dihydro-2H-azepino[4,5-b]indole-5-carboxylate
SYSTEMATIC NAME: ethyl 1,1-dimethyl-3,6-dihydro-2H-azepino[4,5-b]indole-5-carboxylate
MOLECULAR FORMULA: C17H20N2O2
MOLECULAR WEIGHT: 284.3529
SMILES: CCOC(=O)C1=CNCC(C2=C1NC3=CC=CC=C32)(C)C
Structure:
CAS RN: 12249-54-6
CAS Name: gallium silver disulfide
OPENEYE Name: gallium silver disulfide
IUPAC Name: gallium silver disulfide
SYSTEMATIC NAME: gallium silver disulfide
MOLECULAR FORMULA: AgGaS2
MOLECULAR WEIGHT: 241.7212
SMILES: [S-2].[S-2].[Ga+3].[Ag+]
Structure:
CAS RN: 68988-92-1
CAS Name: [7-(dimethylamino)-3-phenothiazinylidene]-dimethylammonium; 2-(2,4,5,7-tetrabromo-3,6-dihydroxy-9-xanthen-10-iumyl)benzoic acid
OPENEYE Name: [7-(dimethylamino)phenothiazin-3-ylidene]-dimethyl-ammonium; 2-(2,4,5,7-tetrabromo-3,6-dihydroxy-xanthen-10-ium-9-yl)benzoic acid
IUPAC Name: [7-(dimethylamino)phenothiazin-3-ylidene]-dimethylazanium; 2-(2,4,5,7-tetrabromo-3,6-dihydroxyxanthen-10-ium-9-yl)benzoic acid
SYSTEMATIC NAME: [7-(dimethylamino)phenothiazin-3-ylidene]-dimethyl-azanium; 2-[2,4,5,7-tetrakis(bromanyl)-3,6-bis(oxidanyl)xanthen-10-ium-9-yl]benzoic acid
MOLECULAR FORMULA: C36H27Br4N3O5S+2
MOLECULAR WEIGHT: 933.29768
SMILES: CN(C)C1=CC2=C(C=C1)N=C3C=CC(=[N+](C)C)C=C3S2.C1=CC=C(C(=C1)C2=C3C=C(C(=C(C3=[O+]C4=C(C(=C(C=C24)Br)O)Br)Br)O)Br)C(=O)O
Structure:
CAS RN: 12027-47-3
CAS Name: tetrasodium; dioxotungsteniooxy-(oxido(dioxo)tungstenio)oxy-dioxotungsten; silicic acid
OPENEYE Name: tetrasodium; dioxotungsteniooxy-(oxido(dioxo)tungstenio)oxy-dioxo-tungsten; silicic acid
IUPAC Name: tetrasodium; dioxotungsteniooxy-(oxido(dioxo)tungstenio)oxy-dioxotungsten; silicic acid
SYSTEMATIC NAME: tetrasodium; bis(oxidanylidene)tungsteniooxy-(oxidanidyl-bis(oxidanylidene)tungstenio)oxy-bis(oxidanylidene)tungsten; silicic acid
MOLECULAR FORMULA: H4Na4O40SiW12
MOLECULAR WEIGHT: 2970.13234
SMILES: O[Si](O)(O)O.[O-][W](=O)(=O)O[W](=O)(=O)O[W](=O)=O.[O-][W](=O)(=O)O[W](=O)(=O)O[W](=O)=O.[O-][W](=O)(=O)O[W](=O)(=O)O[W](=O)=O.[O-][W](=O)(=O)O[W](=O)(=O)O[W](=O)=O.[Na+].[Na+].[Na+].[Na+]
Structure:
CAS RN: 34038-87-4
CAS Name: N8,N8,3-trimethylphenazine-2,8-diamine hydroiodide
OPENEYE Name: N8,N8,3-trimethylphenazine-2,8-diamine hydroiodide
IUPAC Name: 8-N,8-N,3-trimethylphenazine-2,8-diamine hydroiodide
SYSTEMATIC NAME: N8,N8,3-trimethylphenazine-2,8-diamine hydroiodide
MOLECULAR FORMULA: C15H17IN4
MOLECULAR WEIGHT: 380.22675
SMILES: CC1=CC2=NC3=C(C=C(C=C3)N(C)C)N=C2C=C1N.I
Structure:
CAS RN: 8004-86-2
CAS Name: N-ethyl-4-[[4-(ethylamino)phenyl]-(4-ethylimino-3-methyl-1-cyclohexa-2,5-dienylidene)methyl]aniline hydrochloride
OPENEYE Name: N-ethyl-4-[[4-(ethylamino)phenyl]-(4-ethylimino-3-methyl-cyclohexa-2,5-dien-1-ylidene)methyl]aniline hydrochloride
IUPAC Name: N-ethyl-4-[[4-(ethylamino)phenyl]-(4-ethylimino-3-methylcyclohexa-2,5-dien-1-ylidene)methyl]aniline hydrochloride
SYSTEMATIC NAME: N-ethyl-4-[[4-(ethylamino)phenyl]-(4-ethylimino-3-methyl-cyclohexa-2,5-dien-1-ylidene)methyl]aniline hydrochloride
MOLECULAR FORMULA: C26H32ClN3
MOLECULAR WEIGHT: 422.00538
SMILES: CCNC1=CC=C(C=C1)C(=C2C=CC(=NCC)C(=C2)C)C3=CC=C(C=C3)NCC.Cl
Structure:
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