Product OPENEYE NAME: 3,4-dimethyl-5-[4-(2-phenylethyl)piperazin-4-ium-1-carbonyl]-1H-pyridazin-6-one
CAS Name: 3,4-dimethyl-5-[oxo-[4-(2-phenylethyl)-1-piperazin-4-iumyl]methyl]-1H-pyridazin-6-one
IUPAC NAME: 3,4-dimethyl-5-[4-(2-phenylethyl)piperazin-4-ium-1-carbonyl]-1H-pyridazin-6-one
SYSTEMATIC NAME: 3,4-dimethyl-5-[4-(2-phenylethyl)piperazin-4-ium-1-yl]carbonyl-1H-pyridazin-6-one
MOLECULAR FORMULA: C19H25N4O2+
MOLECULAR WEIGHT: 341.4274
SMILES: CC1=C(C(=O)NN=C1C)C(=O)N2CC[NH+](CC2)CCC3=CC=CC=C3
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Product OPENEYE NAME: 3,4-dimethyl-5-[4-(2-phenylethyl)piperazine-1-carbonyl]-1H-pyridazin-6-one
CAS Name: 3,4-dimethyl-5-[oxo-[4-(2-phenylethyl)-1-piperazinyl]methyl]-1H-pyridazin-6-one
IUPAC NAME: 3,4-dimethyl-5-[4-(2-phenylethyl)piperazine-1-carbonyl]-1H-pyridazin-6-one
SYSTEMATIC NAME: 3,4-dimethyl-5-[4-(2-phenylethyl)piperazin-1-yl]carbonyl-1H-pyridazin-6-one
MOLECULAR FORMULA: C19H24N4O2
MOLECULAR WEIGHT: 340.41946
SMILES: CC1=C(C(=O)NN=C1C)C(=O)N2CCN(CC2)CCC3=CC=CC=C3
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Product OPENEYE NAME: ethyl N-[(1S)-2-methyl-1-[[2-(pyrazol-1-ylmethyl)phenyl]methylcarbamoyl]propyl]carbamate
CAS Name: N-[(2S)-3-methyl-1-oxo-1-[[2-(1-pyrazolylmethyl)phenyl]methylamino]butan-2-yl]carbamic acid ethyl ester
IUPAC NAME: ethyl N-[(2S)-3-methyl-1-oxo-1-[[2-(pyrazol-1-ylmethyl)phenyl]methylamino]butan-2-yl]carbamate
SYSTEMATIC NAME: ethyl N-[(2S)-3-methyl-1-oxidanylidene-1-[[2-(pyrazol-1-ylmethyl)phenyl]methylamino]butan-2-yl]carbamate
MOLECULAR FORMULA: C19H26N4O3
MOLECULAR WEIGHT: 358.43474
SMILES: CCOC(=O)N[C@@H](C(C)C)C(=O)NCC1=CC=CC=C1CN2C=CC=N2
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Product OPENEYE NAME: ethyl N-[(1R)-2-methyl-1-[[2-(pyrazol-1-ylmethyl)phenyl]methylcarbamoyl]propyl]carbamate
CAS Name: N-[(2R)-3-methyl-1-oxo-1-[[2-(1-pyrazolylmethyl)phenyl]methylamino]butan-2-yl]carbamic acid ethyl ester
IUPAC NAME: ethyl N-[(2R)-3-methyl-1-oxo-1-[[2-(pyrazol-1-ylmethyl)phenyl]methylamino]butan-2-yl]carbamate
SYSTEMATIC NAME: ethyl N-[(2R)-3-methyl-1-oxidanylidene-1-[[2-(pyrazol-1-ylmethyl)phenyl]methylamino]butan-2-yl]carbamate
MOLECULAR FORMULA: C19H26N4O3
MOLECULAR WEIGHT: 358.43474
SMILES: CCOC(=O)N[C@H](C(C)C)C(=O)NCC1=CC=CC=C1CN2C=CC=N2
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Product OPENEYE NAME: 3,4-dimethyl-6-oxo-N-[[2-(pyrazol-1-ylmethyl)phenyl]methyl]-1H-pyridazine-5-carboxamide
CAS Name: 3,4-dimethyl-6-oxo-N-[[2-(1-pyrazolylmethyl)phenyl]methyl]-1H-pyridazine-5-carboxamide
IUPAC NAME: 3,4-dimethyl-6-oxo-N-[[2-(pyrazol-1-ylmethyl)phenyl]methyl]-1H-pyridazine-5-carboxamide
SYSTEMATIC NAME: 3,4-dimethyl-6-oxidanylidene-N-[[2-(pyrazol-1-ylmethyl)phenyl]methyl]-1H-pyridazine-5-carboxamide
MOLECULAR FORMULA: C18H19N5O2
MOLECULAR WEIGHT: 337.37576
SMILES: CC1=C(C(=O)NN=C1C)C(=O)NCC2=CC=CC=C2CN3C=CC=N3
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Product OPENEYE NAME: N-[(1R)-1-methyl-2-oxo-2-[4-[(2-phenylthiazol-4-yl)methyl]piperazin-1-yl]ethyl]thiophene-2-sulfonamide
CAS Name: N-[(2R)-1-oxo-1-[4-[(2-phenyl-4-thiazolyl)methyl]-1-piperazinyl]propan-2-yl]-2-thiophenesulfonamide
IUPAC NAME: N-[(2R)-1-oxo-1-[4-[(2-phenyl-1,3-thiazol-4-yl)methyl]piperazin-1-yl]propan-2-yl]thiophene-2-sulfonamide
SYSTEMATIC NAME: N-[(2R)-1-oxidanylidene-1-[4-[(2-phenyl-1,3-thiazol-4-yl)methyl]piperazin-1-yl]propan-2-yl]thiophene-2-sulfonamide
MOLECULAR FORMULA: C21H24N4O3S3
MOLECULAR WEIGHT: 476.63526
SMILES: C[C@H](C(=O)N1CCN(CC1)CC2=CSC(=N2)C3=CC=CC=C3)NS(=O)(=O)C4=CC=CS4
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Product OPENEYE NAME: N-[(1S)-1-methyl-2-oxo-2-[4-[(2-phenylthiazol-4-yl)methyl]piperazin-1-yl]ethyl]thiophene-2-sulfonamide
CAS Name: N-[(2S)-1-oxo-1-[4-[(2-phenyl-4-thiazolyl)methyl]-1-piperazinyl]propan-2-yl]-2-thiophenesulfonamide
IUPAC NAME: N-[(2S)-1-oxo-1-[4-[(2-phenyl-1,3-thiazol-4-yl)methyl]piperazin-1-yl]propan-2-yl]thiophene-2-sulfonamide
SYSTEMATIC NAME: N-[(2S)-1-oxidanylidene-1-[4-[(2-phenyl-1,3-thiazol-4-yl)methyl]piperazin-1-yl]propan-2-yl]thiophene-2-sulfonamide
MOLECULAR FORMULA: C21H24N4O3S3
MOLECULAR WEIGHT: 476.63526
SMILES: C[C@@H](C(=O)N1CCN(CC1)CC2=CSC(=N2)C3=CC=CC=C3)NS(=O)(=O)C4=CC=CS4
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Product OPENEYE NAME: ethyl N-[3-(3-ethynylanilino)-3-oxo-propyl]carbamate
CAS Name: N-[3-(3-ethynylanilino)-3-oxopropyl]carbamic acid ethyl ester
IUPAC NAME: ethyl N-[3-(3-ethynylanilino)-3-oxopropyl]carbamate
SYSTEMATIC NAME: ethyl N-[3-[(3-ethynylphenyl)amino]-3-oxidanylidene-propyl]carbamate
MOLECULAR FORMULA: C14H16N2O3
MOLECULAR WEIGHT: 260.28844
SMILES: CCOC(=O)NCCC(=O)NC1=CC=CC(=C1)C#C
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Product OPENEYE NAME: [4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-[5-isopropyl-1-(2-pyridyl)pyrazol-4-yl]methanone
CAS Name: [4-(3,4-dimethylphenyl)sulfonyl-1-piperazinyl]-[5-propan-2-yl-1-(2-pyridinyl)-4-pyrazolyl]methanone
IUPAC NAME: [4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-(5-propan-2-yl-1-pyridin-2-ylpyrazol-4-yl)methanone
SYSTEMATIC NAME: [4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-(5-propan-2-yl-1-pyridin-2-yl-pyrazol-4-yl)methanone
MOLECULAR FORMULA: C24H29N5O3S
MOLECULAR WEIGHT: 467.58376
SMILES: CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=C(N(N=C3)C4=CC=CC=N4)C(C)C)C
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Product OPENEYE NAME: [3-[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]-4-methyl-5-thioxo-1,2,4-triazol-1-yl]methyl-[(1R)-2,2-dimethyl-1-phenyl-propyl]ammonium
CAS Name: [3-[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]-4-methyl-5-sulfanylidene-1,2,4-triazol-1-yl]methyl-[(1R)-2,2-dimethyl-1-phenylpropyl]ammonium
IUPAC NAME: [3-[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]-4-methyl-5-sulfanylidene-1,2,4-triazol-1-yl]methyl-[(1R)-2,2-dimethyl-1-phenylpropyl]azanium
SYSTEMATIC NAME: [3-[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]-4-methyl-5-sulfanylidene-1,2,4-triazol-1-yl]methyl-[(1R)-2,2-dimethyl-1-phenyl-propyl]azanium
MOLECULAR FORMULA: C23H29N4O2S+
MOLECULAR WEIGHT: 425.56696
SMILES: CC(C)(C)[C@H](C1=CC=CC=C1)[NH2+]CN2C(=S)N(C(=N2)[C@@H]3COC4=CC=CC=C4O3)C
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Product OPENEYE NAME: 5-[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]-2-[[[(1R)-2,2-dimethyl-1-phenyl-propyl]amino]methyl]-4-methyl-1,2,4-triazole-3-thione
CAS Name: 5-[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]-2-[[[(1R)-2,2-dimethyl-1-phenylpropyl]amino]methyl]-4-methyl-1,2,4-triazole-3-thione
IUPAC NAME: 5-[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]-2-[[[(1R)-2,2-dimethyl-1-phenylpropyl]amino]methyl]-4-methyl-1,2,4-triazole-3-thione
SYSTEMATIC NAME: 5-[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]-2-[[[(1R)-2,2-dimethyl-1-phenyl-propyl]amino]methyl]-4-methyl-1,2,4-triazole-3-thione
MOLECULAR FORMULA: C23H28N4O2S
MOLECULAR WEIGHT: 424.55902
SMILES: CC(C)(C)[C@H](C1=CC=CC=C1)NCN2C(=S)N(C(=N2)[C@@H]3COC4=CC=CC=C4O3)C
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Product OPENEYE NAME: [3-[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]-4-methyl-5-thioxo-1,2,4-triazol-1-yl]methyl-[(1R)-2,2-dimethyl-1-phenyl-propyl]ammonium
CAS Name: [3-[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]-4-methyl-5-sulfanylidene-1,2,4-triazol-1-yl]methyl-[(1R)-2,2-dimethyl-1-phenylpropyl]ammonium
IUPAC NAME: [3-[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]-4-methyl-5-sulfanylidene-1,2,4-triazol-1-yl]methyl-[(1R)-2,2-dimethyl-1-phenylpropyl]azanium
SYSTEMATIC NAME: [3-[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]-4-methyl-5-sulfanylidene-1,2,4-triazol-1-yl]methyl-[(1R)-2,2-dimethyl-1-phenyl-propyl]azanium
MOLECULAR FORMULA: C23H29N4O2S+
MOLECULAR WEIGHT: 425.56696
SMILES: CC(C)(C)[C@H](C1=CC=CC=C1)[NH2+]CN2C(=S)N(C(=N2)[C@H]3COC4=CC=CC=C4O3)C
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Product OPENEYE NAME: 5-[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]-2-[[[(1R)-2,2-dimethyl-1-phenyl-propyl]amino]methyl]-4-methyl-1,2,4-triazole-3-thione
CAS Name: 5-[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]-2-[[[(1R)-2,2-dimethyl-1-phenylpropyl]amino]methyl]-4-methyl-1,2,4-triazole-3-thione
IUPAC NAME: 5-[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]-2-[[[(1R)-2,2-dimethyl-1-phenylpropyl]amino]methyl]-4-methyl-1,2,4-triazole-3-thione
SYSTEMATIC NAME: 5-[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]-2-[[[(1R)-2,2-dimethyl-1-phenyl-propyl]amino]methyl]-4-methyl-1,2,4-triazole-3-thione
MOLECULAR FORMULA: C23H28N4O2S
MOLECULAR WEIGHT: 424.55902
SMILES: CC(C)(C)[C@H](C1=CC=CC=C1)NCN2C(=S)N(C(=N2)[C@H]3COC4=CC=CC=C4O3)C
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Product OPENEYE NAME: [3-[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]-4-methyl-5-thioxo-1,2,4-triazol-1-yl]methyl-[(1S)-2,2-dimethyl-1-phenyl-propyl]ammonium
CAS Name: [3-[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]-4-methyl-5-sulfanylidene-1,2,4-triazol-1-yl]methyl-[(1S)-2,2-dimethyl-1-phenylpropyl]ammonium
IUPAC NAME: [3-[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]-4-methyl-5-sulfanylidene-1,2,4-triazol-1-yl]methyl-[(1S)-2,2-dimethyl-1-phenylpropyl]azanium
SYSTEMATIC NAME: [3-[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]-4-methyl-5-sulfanylidene-1,2,4-triazol-1-yl]methyl-[(1S)-2,2-dimethyl-1-phenyl-propyl]azanium
MOLECULAR FORMULA: C23H29N4O2S+
MOLECULAR WEIGHT: 425.56696
SMILES: CC(C)(C)[C@@H](C1=CC=CC=C1)[NH2+]CN2C(=S)N(C(=N2)[C@@H]3COC4=CC=CC=C4O3)C
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Product OPENEYE NAME: 5-[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]-2-[[[(1S)-2,2-dimethyl-1-phenyl-propyl]amino]methyl]-4-methyl-1,2,4-triazole-3-thione
CAS Name: 5-[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]-2-[[[(1S)-2,2-dimethyl-1-phenylpropyl]amino]methyl]-4-methyl-1,2,4-triazole-3-thione
IUPAC NAME: 5-[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]-2-[[[(1S)-2,2-dimethyl-1-phenylpropyl]amino]methyl]-4-methyl-1,2,4-triazole-3-thione
SYSTEMATIC NAME: 5-[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]-2-[[[(1S)-2,2-dimethyl-1-phenyl-propyl]amino]methyl]-4-methyl-1,2,4-triazole-3-thione
MOLECULAR FORMULA: C23H28N4O2S
MOLECULAR WEIGHT: 424.55902
SMILES: CC(C)(C)[C@@H](C1=CC=CC=C1)NCN2C(=S)N(C(=N2)[C@@H]3COC4=CC=CC=C4O3)C
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Product OPENEYE NAME: [3-[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]-4-methyl-5-thioxo-1,2,4-triazol-1-yl]methyl-[(1S)-2,2-dimethyl-1-phenyl-propyl]ammonium
CAS Name: [3-[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]-4-methyl-5-sulfanylidene-1,2,4-triazol-1-yl]methyl-[(1S)-2,2-dimethyl-1-phenylpropyl]ammonium
IUPAC NAME: [3-[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]-4-methyl-5-sulfanylidene-1,2,4-triazol-1-yl]methyl-[(1S)-2,2-dimethyl-1-phenylpropyl]azanium
SYSTEMATIC NAME: [3-[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]-4-methyl-5-sulfanylidene-1,2,4-triazol-1-yl]methyl-[(1S)-2,2-dimethyl-1-phenyl-propyl]azanium
MOLECULAR FORMULA: C23H29N4O2S+
MOLECULAR WEIGHT: 425.56696
SMILES: CC(C)(C)[C@@H](C1=CC=CC=C1)[NH2+]CN2C(=S)N(C(=N2)[C@H]3COC4=CC=CC=C4O3)C
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Product OPENEYE NAME: 5-[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]-2-[[[(1S)-2,2-dimethyl-1-phenyl-propyl]amino]methyl]-4-methyl-1,2,4-triazole-3-thione
CAS Name: 5-[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]-2-[[[(1S)-2,2-dimethyl-1-phenylpropyl]amino]methyl]-4-methyl-1,2,4-triazole-3-thione
IUPAC NAME: 5-[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]-2-[[[(1S)-2,2-dimethyl-1-phenylpropyl]amino]methyl]-4-methyl-1,2,4-triazole-3-thione
SYSTEMATIC NAME: 5-[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]-2-[[[(1S)-2,2-dimethyl-1-phenyl-propyl]amino]methyl]-4-methyl-1,2,4-triazole-3-thione
MOLECULAR FORMULA: C23H28N4O2S
MOLECULAR WEIGHT: 424.55902
SMILES: CC(C)(C)[C@@H](C1=CC=CC=C1)NCN2C(=S)N(C(=N2)[C@H]3COC4=CC=CC=C4O3)C
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Product OPENEYE NAME: (6R,10R)-2-[[[(1R)-2,2-dimethyl-1-phenyl-propyl]amino]methyl]-6,10-dimethyl-2,4-diazaspiro[4.5]decane-1,3-dione
CAS Name: (6R,10R)-2-[[[(1R)-2,2-dimethyl-1-phenylpropyl]amino]methyl]-6,10-dimethyl-2,4-diazaspiro[4.5]decane-1,3-dione
IUPAC NAME: (6R,10R)-2-[[[(1R)-2,2-dimethyl-1-phenylpropyl]amino]methyl]-6,10-dimethyl-2,4-diazaspiro[4.5]decane-1,3-dione
SYSTEMATIC NAME: (6R,10R)-2-[[[(1R)-2,2-dimethyl-1-phenyl-propyl]amino]methyl]-6,10-dimethyl-2,4-diazaspiro[4.5]decane-1,3-dione
MOLECULAR FORMULA: C22H33N3O2
MOLECULAR WEIGHT: 371.51632
SMILES: C[C@@H]1CCC[C@H](C12C(=O)N(C(=O)N2)CN[C@@H](C3=CC=CC=C3)C(C)(C)C)C
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