Wednesday, November 2, 2011

All Chemical Compounds Information




Product OPENEYE NAME: (3-ethynylphenyl)urea
CAS Name: (3-ethynylphenyl)urea
IUPAC NAME: (3-ethynylphenyl)urea
SYSTEMATIC NAME: 1-(3-ethynylphenyl)urea
MOLECULAR FORMULA: C9H8N2O
MOLECULAR WEIGHT: 160.17262
SMILES: C#CC1=CC(=CC=C1)NC(=O)N
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Product OPENEYE NAME: N-(trifluoromethylsulfonyl)-3-ureido-benzamide
CAS Name: 3-(carbamoylamino)-N-(trifluoromethylsulfonyl)benzamide
IUPAC NAME: 3-(carbamoylamino)-N-(trifluoromethylsulfonyl)benzamide
SYSTEMATIC NAME: 3-(aminocarbonylamino)-N-(trifluoromethylsulfonyl)benzamide
MOLECULAR FORMULA: C9H8F3N3O4S
MOLECULAR WEIGHT: 311.23773
SMILES: C1=CC(=CC(=C1)NC(=O)N)C(=O)NS(=O)(=O)C(F)(F)F
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Product OPENEYE NAME: N-(3-ureidophenyl)sulfonylbenzamide
CAS Name: N-[3-(carbamoylamino)phenyl]sulfonylbenzamide
IUPAC NAME: N-[3-(carbamoylamino)phenyl]sulfonylbenzamide
SYSTEMATIC NAME: N-[3-(aminocarbonylamino)phenyl]sulfonylbenzamide
MOLECULAR FORMULA: C14H13N3O4S
MOLECULAR WEIGHT: 319.33572
SMILES: C1=CC=C(C=C1)C(=O)NS(=O)(=O)C2=CC=CC(=C2)NC(=O)N
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Product OPENEYE NAME: N-(benzenesulfonyl)-3-ureido-benzamide
CAS Name: N-(benzenesulfonyl)-3-(carbamoylamino)benzamide
IUPAC NAME: N-(benzenesulfonyl)-3-(carbamoylamino)benzamide
SYSTEMATIC NAME: 3-(aminocarbonylamino)-N-(phenylsulfonyl)benzamide
MOLECULAR FORMULA: C14H13N3O4S
MOLECULAR WEIGHT: 319.33572
SMILES: C1=CC=C(C=C1)S(=O)(=O)NC(=O)C2=CC(=CC=C2)NC(=O)N
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Product OPENEYE NAME: [4-oxo-6-(3-ureidophenyl)pyran-3-yl] acetate
CAS Name: acetic acid [6-[3-(carbamoylamino)phenyl]-4-oxo-3-pyranyl] ester
IUPAC NAME: [6-[3-(carbamoylamino)phenyl]-4-oxopyran-3-yl] acetate
SYSTEMATIC NAME: [6-[3-(aminocarbonylamino)phenyl]-4-oxidanylidene-pyran-3-yl] ethanoate
MOLECULAR FORMULA: C14H12N2O5
MOLECULAR WEIGHT: 288.25548
SMILES: CC(=O)OC1=COC(=CC1=O)C2=CC(=CC=C2)NC(=O)N
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Product OPENEYE NAME: benzyl N-(1-methyl-3-oxo-2H-1,4-benzodiazepin-2-yl)carbamate
CAS Name: N-(1-methyl-3-oxo-2H-1,4-benzodiazepin-2-yl)carbamic acid (phenylmethyl) ester
IUPAC NAME: benzyl N-(1-methyl-3-oxo-2H-1,4-benzodiazepin-2-yl)carbamate
SYSTEMATIC NAME: (phenylmethyl) N-(1-methyl-3-oxidanylidene-2H-1,4-benzodiazepin-2-yl)carbamate
MOLECULAR FORMULA: C18H17N3O3
MOLECULAR WEIGHT: 323.34588
SMILES: CN1C(C(=O)N=CC2=CC=CC=C21)NC(=O)OCC3=CC=CC=C3
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Product OPENEYE NAME: N-isopropylsulfonyl-3-ureido-benzamide
CAS Name: 3-(carbamoylamino)-N-propan-2-ylsulfonylbenzamide
IUPAC NAME: 3-(carbamoylamino)-N-propan-2-ylsulfonylbenzamide
SYSTEMATIC NAME: 3-(aminocarbonylamino)-N-propan-2-ylsulfonyl-benzamide
MOLECULAR FORMULA: C11H15N3O4S
MOLECULAR WEIGHT: 285.3195
SMILES: CC(C)S(=O)(=O)NC(=O)C1=CC(=CC=C1)NC(=O)N
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Product OPENEYE NAME: tert-butyl 2-amino-6-sulfanyl-benzoate; methane
CAS Name: 2-amino-6-mercaptobenzoic acid tert-butyl ester; methane
IUPAC NAME: tert-butyl 2-amino-6-sulfanylbenzoate; methane
SYSTEMATIC NAME: tert-butyl 2-azanyl-6-sulfanyl-benzoate; methane
MOLECULAR FORMULA: C12H19NO2S
MOLECULAR WEIGHT: 241.34976
SMILES: C.CC(C)(C)OC(=O)C1=C(C=CC=C1S)N
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Product OPENEYE NAME: tert-butyl 2-amino-6-sulfanyl-benzoate
CAS Name: 2-amino-6-mercaptobenzoic acid tert-butyl ester
IUPAC NAME: tert-butyl 2-amino-6-sulfanylbenzoate
SYSTEMATIC NAME: tert-butyl 2-azanyl-6-sulfanyl-benzoate
MOLECULAR FORMULA: C11H15NO2S
MOLECULAR WEIGHT: 225.3073
SMILES: CC(C)(C)OC(=O)C1=C(C=CC=C1S)N
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Product OPENEYE NAME: [3-(pyrazin-2-ylsulfamoyl)phenyl]urea
CAS Name: [3-(2-pyrazinylsulfamoyl)phenyl]urea
IUPAC NAME: [3-(pyrazin-2-ylsulfamoyl)phenyl]urea
SYSTEMATIC NAME: 1-[3-(pyrazin-2-ylsulfamoyl)phenyl]urea
MOLECULAR FORMULA: C11H11N5O3S
MOLECULAR WEIGHT: 293.30174
SMILES: C1=CC(=CC(=C1)S(=O)(=O)NC2=NC=CN=C2)NC(=O)N
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Product OPENEYE NAME: 5-cyclopentyl-1-ethyl-3H-1,4-benzodiazepin-2-one
CAS Name: 5-cyclopentyl-1-ethyl-3H-1,4-benzodiazepin-2-one
IUPAC NAME: 5-cyclopentyl-1-ethyl-3H-1,4-benzodiazepin-2-one
SYSTEMATIC NAME: 5-cyclopentyl-1-ethyl-3H-1,4-benzodiazepin-2-one
MOLECULAR FORMULA: C16H20N2O
MOLECULAR WEIGHT: 256.3428
SMILES: CCN1C(=O)CN=C(C2=CC=CC=C21)C3CCCC3
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Product OPENEYE NAME: 2,2-dimethyl-N-(3-ureidophenyl)sulfonyl-propanamide
CAS Name: N-[3-(carbamoylamino)phenyl]sulfonyl-2,2-dimethylpropanamide
IUPAC NAME: N-[3-(carbamoylamino)phenyl]sulfonyl-2,2-dimethylpropanamide
SYSTEMATIC NAME: N-[3-(aminocarbonylamino)phenyl]sulfonyl-2,2-dimethyl-propanamide
MOLECULAR FORMULA: C12H17N3O4S
MOLECULAR WEIGHT: 299.34608
SMILES: CC(C)(C)C(=O)NS(=O)(=O)C1=CC=CC(=C1)NC(=O)N
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Product OPENEYE NAME: N-(benzenesulfonyl)-2-ureido-benzamide
CAS Name: N-(benzenesulfonyl)-2-(carbamoylamino)benzamide
IUPAC NAME: N-(benzenesulfonyl)-2-(carbamoylamino)benzamide
SYSTEMATIC NAME: 2-(aminocarbonylamino)-N-(phenylsulfonyl)benzamide
MOLECULAR FORMULA: C14H13N3O4S
MOLECULAR WEIGHT: 319.33572
SMILES: C1=CC=C(C=C1)S(=O)(=O)NC(=O)C2=CC=CC=C2NC(=O)N
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Product OPENEYE NAME: 2-methyl-N-(3-ureidophenyl)sulfonyl-propanamide
CAS Name: N-[3-(carbamoylamino)phenyl]sulfonyl-2-methylpropanamide
IUPAC NAME: N-[3-(carbamoylamino)phenyl]sulfonyl-2-methylpropanamide
SYSTEMATIC NAME: N-[3-(aminocarbonylamino)phenyl]sulfonyl-2-methyl-propanamide
MOLECULAR FORMULA: C11H15N3O4S
MOLECULAR WEIGHT: 285.3195
SMILES: CC(C)C(=O)NS(=O)(=O)C1=CC=CC(=C1)NC(=O)N
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Product OPENEYE NAME: [3-(1,3,4-thiadiazol-2-ylsulfamoyl)phenyl]urea
CAS Name: [3-(1,3,4-thiadiazol-2-ylsulfamoyl)phenyl]urea
IUPAC NAME: [3-(1,3,4-thiadiazol-2-ylsulfamoyl)phenyl]urea
SYSTEMATIC NAME: 1-[3-(1,3,4-thiadiazol-2-ylsulfamoyl)phenyl]urea
MOLECULAR FORMULA: C9H9N5O3S2
MOLECULAR WEIGHT: 299.32946
SMILES: C1=CC(=CC(=C1)S(=O)(=O)NC2=NN=CS2)NC(=O)N
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