CAS RN: 6873-54-7
CAS Name: 4-methyl-N-phenylbenzenesulfinamide
OPENEYE Name: 4-methyl-N-phenyl-benzenesulfinamide
IUPAC Name: 4-methyl-N-phenylbenzenesulfinamide
SYSTEMATIC NAME: 4-methyl-N-phenyl-benzenesulfinamide
MOLECULAR FORMULA: C13H13NOS
MOLECULAR WEIGHT: 231.31342
SMILES: CC1=CC=C(C=C1)S(=O)NC2=CC=CC=C2
Structure:
CAS RN: 2046-44-8
CAS Name: 1-(5-oxo-1-phenyl-4H-pyrazol-3-yl)-3-phenylurea
OPENEYE Name: 1-(5-oxo-1-phenyl-4H-pyrazol-3-yl)-3-phenyl-urea
IUPAC Name: 1-(5-oxo-1-phenyl-4H-pyrazol-3-yl)-3-phenylurea
SYSTEMATIC NAME: 1-(5-oxidanylidene-1-phenyl-4H-pyrazol-3-yl)-3-phenyl-urea
MOLECULAR FORMULA: C16H14N4O2
MOLECULAR WEIGHT: 294.30796
SMILES: C1C(=NN(C1=O)C2=CC=CC=C2)NC(=O)NC3=CC=CC=C3
Structure:
CAS RN: 4590-83-4
CAS Name: 4-[(2-hydroxyphenyl)methylidene]-1-phenylpyrazolidine-3,5-dione
OPENEYE Name: 4-[(2-hydroxyphenyl)methylene]-1-phenyl-pyrazolidine-3,5-dione
IUPAC Name: 4-[(2-hydroxyphenyl)methylidene]-1-phenylpyrazolidine-3,5-dione
SYSTEMATIC NAME: 4-[(2-hydroxyphenyl)methylidene]-1-phenyl-pyrazolidine-3,5-dione
MOLECULAR FORMULA: C16H12N2O3
MOLECULAR WEIGHT: 280.27808
SMILES: C1=CC=C(C=C1)N2C(=O)C(=CC3=CC=CC=C3O)C(=O)N2
Structure:
CAS RN: 52472-96-5
CAS Name: acetic acid (5-acetamido-2-phenyl-3-pyrazolyl) ester
OPENEYE Name: (5-acetamido-2-phenyl-pyrazol-3-yl) acetate
IUPAC Name: (5-acetamido-2-phenylpyrazol-3-yl) acetate
SYSTEMATIC NAME: (5-acetamido-2-phenyl-pyrazol-3-yl) ethanoate
MOLECULAR FORMULA: C13H13N3O3
MOLECULAR WEIGHT: 259.26062
SMILES: CC(=O)NC1=NN(C(=C1)OC(=O)C)C2=CC=CC=C2
Structure:
CAS RN: 57965-40-9
CAS Name: 4-[2-(2-oxopropylidene)hydrazinyl]benzoic acid
OPENEYE Name: 4-(2-acetonylidenehydrazino)benzoic acid
IUPAC Name: 4-[2-(2-oxopropylidene)hydrazinyl]benzoic acid
SYSTEMATIC NAME: 4-[2-(2-oxidanylidenepropylidene)hydrazinyl]benzoic acid
MOLECULAR FORMULA: C10H10N2O3
MOLECULAR WEIGHT: 206.198
SMILES: CC(=O)C=NNC1=CC=C(C=C1)C(=O)O
Structure:
CAS RN: 14673-43-9
CAS Name: 3-methyl-5-phenyl-2-sulfanylidene-4-thiazolidinone
OPENEYE Name: 3-methyl-5-phenyl-2-thioxo-thiazolidin-4-one
IUPAC Name: 3-methyl-5-phenyl-2-sulfanylidene-1,3-thiazolidin-4-one
SYSTEMATIC NAME: 3-methyl-5-phenyl-2-sulfanylidene-1,3-thiazolidin-4-one
MOLECULAR FORMULA: C10H9NOS2
MOLECULAR WEIGHT: 223.31456
SMILES: CN1C(=O)C(SC1=S)C2=CC=CC=C2
Structure:
CAS RN: 35610-74-3
CAS Name: 5-cyclohexylidene-3-phenyl-2-sulfanylidene-4-thiazolidinone
OPENEYE Name: 5-cyclohexylidene-3-phenyl-2-thioxo-thiazolidin-4-one
IUPAC Name: 5-cyclohexylidene-3-phenyl-2-sulfanylidene-1,3-thiazolidin-4-one
SYSTEMATIC NAME: 5-cyclohexylidene-3-phenyl-2-sulfanylidene-1,3-thiazolidin-4-one
MOLECULAR FORMULA: C15H15NOS2
MOLECULAR WEIGHT: 289.4157
SMILES: C1CCC(=C2C(=O)N(C(=S)S2)C3=CC=CC=C3)CC1
Structure:
CAS RN: 2144-96-9
CAS Name: N-(5-oxo-1-phenyl-4H-pyrazol-3-yl)benzamide
OPENEYE Name: N-(5-oxo-1-phenyl-4H-pyrazol-3-yl)benzamide
IUPAC Name: N-(5-oxo-1-phenyl-4H-pyrazol-3-yl)benzamide
SYSTEMATIC NAME: N-(5-oxidanylidene-1-phenyl-4H-pyrazol-3-yl)benzamide
MOLECULAR FORMULA: C16H13N3O2
MOLECULAR WEIGHT: 279.29332
SMILES: C1C(=NN(C1=O)C2=CC=CC=C2)NC(=O)C3=CC=CC=C3
Structure:
CAS RN: 55111-68-7
CAS Name: 5-[(4-chlorophenyl)methylidene]-3-phenyl-2-sulfanylidene-4-thiazolidinone
OPENEYE Name: 5-[(4-chlorophenyl)methylene]-3-phenyl-2-thioxo-thiazolidin-4-one
IUPAC Name: 5-[(4-chlorophenyl)methylidene]-3-phenyl-2-sulfanylidene-1,3-thiazolidin-4-one
SYSTEMATIC NAME: 5-[(4-chlorophenyl)methylidene]-3-phenyl-2-sulfanylidene-1,3-thiazolidin-4-one
MOLECULAR FORMULA: C16H10ClNOS2
MOLECULAR WEIGHT: 331.8397
SMILES: C1=CC=C(C=C1)N2C(=O)C(=CC3=CC=C(C=C3)Cl)SC2=S
Structure:
CAS RN: 18332-12-2
CAS Name: 3,5-diphenyl-2-sulfanylidene-4-thiazolidinone
OPENEYE Name: 3,5-diphenyl-2-thioxo-thiazolidin-4-one
IUPAC Name: 3,5-diphenyl-2-sulfanylidene-1,3-thiazolidin-4-one
SYSTEMATIC NAME: 3,5-diphenyl-2-sulfanylidene-1,3-thiazolidin-4-one
MOLECULAR FORMULA: C15H11NOS2
MOLECULAR WEIGHT: 285.38394
SMILES: C1=CC=C(C=C1)C2C(=O)N(C(=S)S2)C3=CC=CC=C3
Structure:
CAS RN: 17326-40-8
CAS Name: 1-phenyl-5-phenylimino-3-pyrazolidinone
OPENEYE Name: 1-phenyl-5-phenylimino-pyrazolidin-3-one
IUPAC Name: 1-phenyl-5-phenyliminopyrazolidin-3-one
SYSTEMATIC NAME: 1-phenyl-5-phenylimino-pyrazolidin-3-one
MOLECULAR FORMULA: C15H13N3O
MOLECULAR WEIGHT: 251.28322
SMILES: C1C(=O)NN(C1=NC2=CC=CC=C2)C3=CC=CC=C3
Structure:
CAS RN: 29816-35-1
CAS Name: N,N'-bis(1-phenylethylideneamino)oxamide
OPENEYE Name: N,N'-bis(1-phenylethylideneamino)oxamide
IUPAC Name: N,N'-bis(1-phenylethylideneamino)oxamide
SYSTEMATIC NAME: N,N'-bis(1-phenylethylideneamino)ethanediamide
MOLECULAR FORMULA: C18H18N4O2
MOLECULAR WEIGHT: 322.36112
SMILES: CC(=NNC(=O)C(=O)NN=C(C)C1=CC=CC=C1)C2=CC=CC=C2
Structure:
CAS RN: 4891-93-4
CAS Name: 2-(4-oxo-3-phenyl-2-sulfanylidene-5-thiazolidinyl)acetic acid
OPENEYE Name: 2-(4-oxo-3-phenyl-2-thioxo-thiazolidin-5-yl)acetic acid
IUPAC Name: 2-(4-oxo-3-phenyl-2-sulfanylidene-1,3-thiazolidin-5-yl)acetic acid
SYSTEMATIC NAME: 2-(4-oxidanylidene-3-phenyl-2-sulfanylidene-1,3-thiazolidin-5-yl)ethanoic acid
MOLECULAR FORMULA: C11H9NO3S2
MOLECULAR WEIGHT: 267.32406
SMILES: C1=CC=C(C=C1)N2C(=O)C(SC2=S)CC(=O)O
Structure:
CAS RN: 20260-35-9
CAS Name: 3-[[2-[2-(4-ethoxy-4-oxobutan-2-ylidene)hydrazinyl]-1,2-dioxoethyl]hydrazinylidene]butanoic acid ethyl ester
OPENEYE Name: ethyl 3-[[2-[2-(3-ethoxy-1-methyl-3-oxo-propylidene)hydrazino]-2-oxo-acetyl]hydrazono]butanoate
IUPAC Name: ethyl 3-[[2-[2-(4-ethoxy-4-oxobutan-2-ylidene)hydrazinyl]-2-oxoacetyl]hydrazinylidene]butanoate
SYSTEMATIC NAME: ethyl 3-[[2-[2-(4-ethoxy-4-oxidanylidene-butan-2-ylidene)hydrazinyl]-2-oxidanylidene-ethanoyl]hydrazinylidene]butanoate
MOLECULAR FORMULA: C14H22N4O6
MOLECULAR WEIGHT: 342.34768
SMILES: CCOC(=O)CC(=NNC(=O)C(=O)NN=C(C)CC(=O)OCC)C
Structure:
CAS RN: 68761-49-9
CAS Name: 3-methyl-4-(phenylmethylene)-1H-pyrazol-5-one
OPENEYE Name: 4-benzylidene-3-methyl-1H-pyrazol-5-one
IUPAC Name: 4-benzylidene-3-methyl-1H-pyrazol-5-one
SYSTEMATIC NAME: 3-methyl-4-(phenylmethylidene)-1H-pyrazol-5-one
MOLECULAR FORMULA: C11H10N2O
MOLECULAR WEIGHT: 186.2099
SMILES: CC1=NNC(=O)C1=CC2=CC=CC=C2
Structure:
CAS RN: 29816-51-1
CAS Name: N,N'-bis(1-phenylethylideneamino)propanediamide
OPENEYE Name: N,N'-bis(1-phenylethylideneamino)propanediamide
IUPAC Name: N,N'-bis(1-phenylethylideneamino)propanediamide
SYSTEMATIC NAME: N,N'-bis(1-phenylethylideneamino)propanediamide
MOLECULAR FORMULA: C19H20N4O2
MOLECULAR WEIGHT: 336.3877
SMILES: CC(=NNC(=O)CC(=O)NN=C(C)C1=CC=CC=C1)C2=CC=CC=C2
Structure:
CAS RN: 4290-94-2
CAS Name: 1-ethylindole-2,3-dione
OPENEYE Name: 1-ethylindoline-2,3-dione
IUPAC Name: 1-ethylindole-2,3-dione
SYSTEMATIC NAME: 1-ethylindole-2,3-dione
MOLECULAR FORMULA: C10H9NO2
MOLECULAR WEIGHT: 175.18396
SMILES: CCN1C2=CC=CC=C2C(=O)C1=O
Structure:
CAS RN: 6386-15-8
CAS Name: 5-methyl-4-nitroso-1,2-dihydropyrazol-3-one
OPENEYE Name: 5-methyl-4-nitroso-1,2-dihydropyrazol-3-one
IUPAC Name: 5-methyl-4-nitroso-1,2-dihydropyrazol-3-one
SYSTEMATIC NAME: 5-methyl-4-nitroso-1,2-dihydropyrazol-3-one
MOLECULAR FORMULA: C4H5N3O2
MOLECULAR WEIGHT: 127.1014
SMILES: CC1=C(C(=O)NN1)N=O
Structure:
CAS RN: 40848-87-1
CAS Name: 1-methyl-3-[(phenylmethylene)amino]urea
OPENEYE Name: 1-(benzylideneamino)-3-methyl-urea
IUPAC Name: 1-(benzylideneamino)-3-methylurea
SYSTEMATIC NAME: 1-methyl-3-[(phenylmethylidene)amino]urea
MOLECULAR FORMULA: C9H11N3O
MOLECULAR WEIGHT: 177.20314
SMILES: CNC(=O)NN=CC1=CC=CC=C1
Structure:
CAS RN: 74971-70-3
CAS Name: 2-octylpropane-1,3-diol
OPENEYE Name: 2-octylpropane-1,3-diol
IUPAC Name: 2-octylpropane-1,3-diol
SYSTEMATIC NAME: 2-octylpropane-1,3-diol
MOLECULAR FORMULA: C11H24O2
MOLECULAR WEIGHT: 188.30706
SMILES: CCCCCCCCC(CO)CO
Structure:
CAS RN: 90586-92-8
CAS Name: 3-chloro-5-methyl-1H-pyrazole
OPENEYE Name: 3-chloro-5-methyl-1H-pyrazole
IUPAC Name: 3-chloro-5-methyl-1H-pyrazole
SYSTEMATIC NAME: 3-chloranyl-5-methyl-1H-pyrazole
MOLECULAR FORMULA: C4H5ClN2
MOLECULAR WEIGHT: 116.5489
SMILES: CC1=CC(=NN1)Cl
Structure:
CAS RN: 15017-12-6
CAS Name: N-(4-oxopentan-2-ylideneamino)-4-pyridinecarboxamide
OPENEYE Name: N-[(1-methyl-3-oxo-butylidene)amino]pyridine-4-carboxamide
IUPAC Name: N-(4-oxopentan-2-ylideneamino)pyridine-4-carboxamide
SYSTEMATIC NAME: N-(4-oxidanylidenepentan-2-ylideneamino)pyridine-4-carboxamide
MOLECULAR FORMULA: C11H13N3O2
MOLECULAR WEIGHT: 219.23982
SMILES: CC(=NNC(=O)C1=CC=NC=C1)CC(=O)C
Structure:
CAS RN: 4703-19-9
CAS Name: 4-methyl-N,N-diphenylbenzenesulfonamide
OPENEYE Name: 4-methyl-N,N-diphenyl-benzenesulfonamide
IUPAC Name: 4-methyl-N,N-diphenylbenzenesulfonamide
SYSTEMATIC NAME: 4-methyl-N,N-diphenyl-benzenesulfonamide
MOLECULAR FORMULA: C19H17NO2S
MOLECULAR WEIGHT: 323.40878
SMILES: CC1=CC=C(C=C1)S(=O)(=O)N(C2=CC=CC=C2)C3=CC=CC=C3
Structure:
CAS RN: 32387-09-0
CAS Name: 2-(cinnamylideneamino)isoindole-1,3-dione
OPENEYE Name: 2-(cinnamylideneamino)isoindoline-1,3-dione
IUPAC Name: 2-(cinnamylideneamino)isoindole-1,3-dione
SYSTEMATIC NAME: 2-(cinnamylideneamino)isoindole-1,3-dione
MOLECULAR FORMULA: C17H12N2O2
MOLECULAR WEIGHT: 276.28938
SMILES: C1=CC=C(C=C1)C=CC=NN2C(=O)C3=CC=CC=C3C2=O
Structure:
CAS RN: 57353-95-4
CAS Name: 2-(propan-2-ylideneamino)isoindole-1,3-dione
OPENEYE Name: 2-(isopropylideneamino)isoindoline-1,3-dione
IUPAC Name: 2-(propan-2-ylideneamino)isoindole-1,3-dione
SYSTEMATIC NAME: 2-(propan-2-ylideneamino)isoindole-1,3-dione
MOLECULAR FORMULA: C11H10N2O2
MOLECULAR WEIGHT: 202.2093
SMILES: CC(=NN1C(=O)C2=CC=CC=C2C1=O)C
Structure:
CAS RN: 85438-53-5
CAS Name: 2-[4-[4-(1,3-dioxo-2-isoindolyl)phenyl]sulfonylphenyl]isoindole-1,3-dione
OPENEYE Name: 2-[4-[4-(1,3-dioxoisoindolin-2-yl)phenyl]sulfonylphenyl]isoindoline-1,3-dione
IUPAC Name: 2-[4-[4-(1,3-dioxoisoindol-2-yl)phenyl]sulfonylphenyl]isoindole-1,3-dione
SYSTEMATIC NAME: 2-[4-[4-[1,3-bis(oxidanylidene)isoindol-2-yl]phenyl]sulfonylphenyl]isoindole-1,3-dione
MOLECULAR FORMULA: C28H16N2O6S
MOLECULAR WEIGHT: 508.50144
SMILES: C1=CC=C2C(=C1)C(=O)N(C2=O)C3=CC=C(C=C3)S(=O)(=O)C4=CC=C(C=C4)N5C(=O)C6=CC=CC=C6C5=O
Structure:
CAS RN: 3151-45-9
CAS Name: 4-(dodecylamino)-4-oxobutanoic acid
OPENEYE Name: 4-(dodecylamino)-4-oxo-butanoic acid
IUPAC Name: 4-(dodecylamino)-4-oxobutanoic acid
SYSTEMATIC NAME: 4-(dodecylamino)-4-oxidanylidene-butanoic acid
MOLECULAR FORMULA: C16H31NO3
MOLECULAR WEIGHT: 285.42224
SMILES: CCCCCCCCCCCCNC(=O)CCC(=O)O
Structure:
CAS RN: 30725-08-7
CAS Name: 4,5-bis(4-bromoanilino)cyclohexa-3,5-diene-1,2-dione
OPENEYE Name: 4,5-bis(4-bromoanilino)-1,2-benzoquinone
IUPAC Name: 4,5-bis(4-bromoanilino)cyclohexa-3,5-diene-1,2-dione
SYSTEMATIC NAME: 4,5-bis[(4-bromophenyl)amino]cyclohexa-3,5-diene-1,2-dione
MOLECULAR FORMULA: C18H12Br2N2O2
MOLECULAR WEIGHT: 448.10808
SMILES: C1=CC(=CC=C1NC2=CC(=O)C(=O)C=C2NC3=CC=C(C=C3)Br)Br
Structure:
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