CAS RN: 146824-90-0
CAS Name: 3-methoxy-1-(3,4,5-trimethoxyphenyl)-4-pyridazinone
OPENEYE Name: 3-methoxy-1-(3,4,5-trimethoxyphenyl)pyridazin-4-one
IUPAC Name: 3-methoxy-1-(3,4,5-trimethoxyphenyl)pyridazin-4-one
SYSTEMATIC NAME: 3-methoxy-1-(3,4,5-trimethoxyphenyl)pyridazin-4-one
MOLECULAR FORMULA: C14H16N2O5
MOLECULAR WEIGHT: 292.28724
SMILES: COC1=CC(=CC(=C1OC)OC)N2C=CC(=O)C(=N2)OC
Structure:
CAS RN: 146824-91-1
CAS Name: 3-methoxy-6-methyl-1-(3,4,5-trimethoxyphenyl)-4-pyridazinone
OPENEYE Name: 3-methoxy-6-methyl-1-(3,4,5-trimethoxyphenyl)pyridazin-4-one
IUPAC Name: 3-methoxy-6-methyl-1-(3,4,5-trimethoxyphenyl)pyridazin-4-one
SYSTEMATIC NAME: 3-methoxy-6-methyl-1-(3,4,5-trimethoxyphenyl)pyridazin-4-one
MOLECULAR FORMULA: C15H18N2O5
MOLECULAR WEIGHT: 306.31382
SMILES: CC1=CC(=O)C(=NN1C2=CC(=C(C(=C2)OC)OC)OC)OC
Structure:
CAS RN: 65322-64-7
CAS Name: [2,2-dimethyl-4-(1-naphthalenyl)-3,3a-dihydro-1H-perimidin-4-yl]-phenyldiazenyldiazene
OPENEYE Name: [2,2-dimethyl-4-(1-naphthyl)-3,3a-dihydro-1H-perimidin-4-yl]-phenylazo-diazene
IUPAC Name: (2,2-dimethyl-4-naphthalen-1-yl-3,3a-dihydro-1H-perimidin-4-yl)-phenyldiazenyldiazene
SYSTEMATIC NAME: (2,2-dimethyl-4-naphthalen-1-yl-3,3a-dihydro-1H-perimidin-4-yl)-phenyldiazenyl-diazene
MOLECULAR FORMULA: C29H26N6
MOLECULAR WEIGHT: 458.55694
SMILES: CC1(NC2C3=C(C=CC=C3N1)C=CC2(C4=CC=CC5=CC=CC=C54)N=NN=NC6=CC=CC=C6)C
Structure:
CAS RN: 77728-33-7
CAS Name: acetic acid [(8R,9S,10R,13S,14S,17R)-17-ethynyl-13-methyl-3-oxo-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-yl] ester; (8R,9S,13S,14S,17S)-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,17-diol
OPENEYE Name: [(8R,9S,10R,13S,14S,17R)-17-ethynyl-13-methyl-3-oxo-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-yl] acetate; (8R,9S,13S,14S,17S)-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,17-diol
IUPAC Name: [(8R,9S,10R,13S,14S,17R)-17-ethynyl-13-methyl-3-oxo-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-yl] acetate; (8R,9S,13S,14S,17S)-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,17-diol
SYSTEMATIC NAME: [(8R,9S,10R,13S,14S,17R)-17-ethynyl-13-methyl-3-oxidanylidene-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-yl] ethanoate; (8R,9S,13S,14S,17S)-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,17-diol
MOLECULAR FORMULA: C40H52O5
MOLECULAR WEIGHT: 612.83788
SMILES: CC(=O)O[C@]1(CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CCC4=CC(=O)CC[C@H]34)C)C#C.C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2O)CCC4=C3C=CC(=C4)O
Structure:
CAS RN: 57511-63-4
CAS Name: phosphoric acid (4-methylsulfonylphenyl) dipropyl ester
OPENEYE Name: (4-methylsulfonylphenyl) dipropyl phosphate
IUPAC Name: (4-methylsulfonylphenyl) dipropyl phosphate
SYSTEMATIC NAME: (4-methylsulfonylphenyl) dipropyl phosphate
MOLECULAR FORMULA: C13H21O6PS
MOLECULAR WEIGHT: 336.341001
SMILES: CCCOP(=O)(OCCC)OC1=CC=C(C=C1)S(=O)(=O)C
Structure:
CAS RN: 54593-35-0
CAS Name: (2R)-2-(4-hydroxyphenyl)-2-[(2R)-2-piperidinyl]acetic acid methyl ester
OPENEYE Name: methyl (2R)-2-(4-hydroxyphenyl)-2-[(2R)-2-piperidyl]acetate
IUPAC Name: methyl (2R)-2-(4-hydroxyphenyl)-2-[(2R)-piperidin-2-yl]acetate
SYSTEMATIC NAME: methyl (2R)-2-(4-hydroxyphenyl)-2-[(2R)-piperidin-2-yl]ethanoate
MOLECULAR FORMULA: C14H19NO3
MOLECULAR WEIGHT: 249.30556
SMILES: COC(=O)[C@@H]([C@H]1CCCCN1)C2=CC=C(C=C2)O
Structure:
CAS RN: 54593-32-7
CAS Name: (2R)-2-(4-hydroxyphenyl)-2-[(2R)-2-piperidinyl]acetic acid
OPENEYE Name: (2R)-2-(4-hydroxyphenyl)-2-[(2R)-2-piperidyl]acetic acid
IUPAC Name: (2R)-2-(4-hydroxyphenyl)-2-[(2R)-piperidin-2-yl]acetic acid
SYSTEMATIC NAME: (2R)-2-(4-hydroxyphenyl)-2-[(2R)-piperidin-2-yl]ethanoic acid
MOLECULAR FORMULA: C13H17NO3
MOLECULAR WEIGHT: 235.27898
SMILES: C1CCN[C@H](C1)[C@@H](C2=CC=C(C=C2)O)C(=O)O
Structure:
CAS RN: 55503-20-3
CAS Name: 7-ethyl-2-methyl-4-oxo-5-thieno[2,3-b]pyridinecarboxylic acid
OPENEYE Name: 7-ethyl-2-methyl-4-oxo-thieno[2,3-b]pyridine-5-carboxylic acid
IUPAC Name: 7-ethyl-2-methyl-4-oxothieno[2,3-b]pyridine-5-carboxylic acid
SYSTEMATIC NAME: 7-ethyl-2-methyl-4-oxidanylidene-thieno[2,3-b]pyridine-5-carboxylic acid
MOLECULAR FORMULA: C11H11NO3S
MOLECULAR WEIGHT: 237.27494
SMILES: CCN1C=C(C(=O)C2=C1SC(=C2)C)C(=O)O
Structure:
CAS RN: 69517-65-3
CAS Name: N-[3-(1,3-dimethyl-2,6-dioxo-7-purinyl)-2-hydroxypropyl]-N-methyl-3-pyridinecarboxamide
OPENEYE Name: N-[3-(1,3-dimethyl-2,6-dioxo-purin-7-yl)-2-hydroxy-propyl]-N-methyl-pyridine-3-carboxamide
IUPAC Name: N-[3-(1,3-dimethyl-2,6-dioxopurin-7-yl)-2-hydroxypropyl]-N-methylpyridine-3-carboxamide
SYSTEMATIC NAME: N-[3-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]-2-oxidanyl-propyl]-N-methyl-pyridine-3-carboxamide
MOLECULAR FORMULA: C17H20N6O4
MOLECULAR WEIGHT: 372.3785
SMILES: CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC(CN(C)C(=O)C3=CN=CC=C3)O
Structure:
CAS RN: 69517-64-2
CAS Name: N-[3-(1,3-dimethyl-2,6-dioxo-7-purinyl)-2-hydroxypropyl]-N-methyl-4-pyridinecarboxamide
OPENEYE Name: N-[3-(1,3-dimethyl-2,6-dioxo-purin-7-yl)-2-hydroxy-propyl]-N-methyl-pyridine-4-carboxamide
IUPAC Name: N-[3-(1,3-dimethyl-2,6-dioxopurin-7-yl)-2-hydroxypropyl]-N-methylpyridine-4-carboxamide
SYSTEMATIC NAME: N-[3-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]-2-oxidanyl-propyl]-N-methyl-pyridine-4-carboxamide
MOLECULAR FORMULA: C17H20N6O4
MOLECULAR WEIGHT: 372.3785
SMILES: CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC(CN(C)C(=O)C3=CC=NC=C3)O
Structure:
CAS RN: 73972-53-9
CAS Name: 6-chloro-9-[(2R)-1-phenylpropan-2-yl]purine
OPENEYE Name: 6-chloro-9-[(1R)-1-methyl-2-phenyl-ethyl]purine
IUPAC Name: 6-chloro-9-[(2R)-1-phenylpropan-2-yl]purine
SYSTEMATIC NAME: 6-chloranyl-9-[(2R)-1-phenylpropan-2-yl]purine
MOLECULAR FORMULA: C14H13ClN4
MOLECULAR WEIGHT: 272.73282
SMILES: C[C@H](CC1=CC=CC=C1)N2C=NC3=C2N=CN=C3Cl
Structure:
CAS RN: 170493-70-6
CAS Name: (2S)-1-(8-methoxy-4,5-dihydrobenzo[g]indol-1-yl)-2-propanamine
OPENEYE Name: (2S)-1-(8-methoxy-4,5-dihydrobenzo[g]indol-1-yl)propan-2-amine
IUPAC Name: (2S)-1-(8-methoxy-4,5-dihydrobenzo[g]indol-1-yl)propan-2-amine
SYSTEMATIC NAME: (2S)-1-(8-methoxy-4,5-dihydrobenzo[g]indol-1-yl)propan-2-amine
MOLECULAR FORMULA: C16H20N2O
MOLECULAR WEIGHT: 256.3428
SMILES: C[C@@H](CN1C=CC2=C1C3=C(CC2)C=CC(=C3)OC)N
Structure:
CAS RN: 170493-64-8
CAS Name: (2S)-1-(7-methoxy-4,4-dimethyl-1-indeno[1,2-b]pyrrolyl)-2-propanamine
OPENEYE Name: (2S)-1-(7-methoxy-4,4-dimethyl-indeno[1,2-b]pyrrol-1-yl)propan-2-amine
IUPAC Name: (2S)-1-(7-methoxy-4,4-dimethylindeno[1,2-b]pyrrol-1-yl)propan-2-amine
SYSTEMATIC NAME: (2S)-1-(7-methoxy-4,4-dimethyl-indeno[1,2-b]pyrrol-1-yl)propan-2-amine
MOLECULAR FORMULA: C17H22N2O
MOLECULAR WEIGHT: 270.36938
SMILES: C[C@@H](CN1C=CC2=C1C3=C(C2(C)C)C=CC(=C3)OC)N
Structure:
CAS RN: 170493-66-0
CAS Name: (2S)-1-(7-methoxy-4H-indeno[1,2-b]pyrrol-1-yl)-2-propanamine
OPENEYE Name: (2S)-1-(7-methoxy-4H-indeno[1,2-b]pyrrol-1-yl)propan-2-amine
IUPAC Name: (2S)-1-(7-methoxy-4H-indeno[1,2-b]pyrrol-1-yl)propan-2-amine
SYSTEMATIC NAME: (2S)-1-(7-methoxy-4H-indeno[1,2-b]pyrrol-1-yl)propan-2-amine
MOLECULAR FORMULA: C15H18N2O
MOLECULAR WEIGHT: 242.31622
SMILES: C[C@@H](CN1C=CC2=C1C3=C(C2)C=CC(=C3)OC)N
Structure:
CAS RN: 170493-74-0
CAS Name: (2S)-1-(8-methoxy-1-benzo[g]indolyl)-2-propanamine
OPENEYE Name: (2S)-1-(8-methoxybenzo[g]indol-1-yl)propan-2-amine
IUPAC Name: (2S)-1-(8-methoxybenzo[g]indol-1-yl)propan-2-amine
SYSTEMATIC NAME: (2S)-1-(8-methoxybenzo[g]indol-1-yl)propan-2-amine
MOLECULAR FORMULA: C16H18N2O
MOLECULAR WEIGHT: 254.32692
SMILES: C[C@@H](CN1C=CC2=C1C3=C(C=C2)C=CC(=C3)OC)N
Structure:
CAS RN: 170493-80-8
CAS Name: (2S)-1-(7-methyl-4H-indeno[1,2-b]pyrrol-1-yl)-2-propanamine
OPENEYE Name: (2S)-1-(7-methyl-4H-indeno[1,2-b]pyrrol-1-yl)propan-2-amine
IUPAC Name: (2S)-1-(7-methyl-4H-indeno[1,2-b]pyrrol-1-yl)propan-2-amine
SYSTEMATIC NAME: (2S)-1-(7-methyl-4H-indeno[1,2-b]pyrrol-1-yl)propan-2-amine
MOLECULAR FORMULA: C15H18N2
MOLECULAR WEIGHT: 226.31682
SMILES: CC1=CC2=C(CC3=C2N(C=C3)C[C@H](C)N)C=C1
Structure:
CAS RN: 176721-13-4
CAS Name: (2S)-1-(7-methoxy-4H-indeno[1,2-c]pyrazol-1-yl)-2-propanamine
OPENEYE Name: (2S)-1-(7-methoxy-4H-indeno[1,2-c]pyrazol-1-yl)propan-2-amine
IUPAC Name: (2S)-1-(7-methoxy-4H-indeno[1,2-c]pyrazol-1-yl)propan-2-amine
SYSTEMATIC NAME: (2S)-1-(7-methoxy-4H-indeno[1,2-c]pyrazol-1-yl)propan-2-amine
MOLECULAR FORMULA: C14H17N3O
MOLECULAR WEIGHT: 243.30428
SMILES: C[C@@H](CN1C2=C(CC3=C2C=C(C=C3)OC)C=N1)N
Structure:
CAS RN: 176721-15-6
CAS Name: (2S)-1-(4,4,7-trimethyl-1-indeno[1,2-c]pyrazolyl)-2-propanamine
OPENEYE Name: (2S)-1-(4,4,7-trimethylindeno[1,2-c]pyrazol-1-yl)propan-2-amine
IUPAC Name: (2S)-1-(4,4,7-trimethylindeno[1,2-c]pyrazol-1-yl)propan-2-amine
SYSTEMATIC NAME: (2S)-1-(4,4,7-trimethylindeno[1,2-c]pyrazol-1-yl)propan-2-amine
MOLECULAR FORMULA: C16H21N3
MOLECULAR WEIGHT: 255.35804
SMILES: CC1=CC2=C(C=C1)C(C3=C2N(N=C3)C[C@H](C)N)(C)C
Structure:
CAS RN: 176721-17-8
CAS Name: (2S)-1-(7-methoxy-4,4-dimethyl-1-indeno[1,2-c]pyrazolyl)-2-propanamine
OPENEYE Name: (2S)-1-(7-methoxy-4,4-dimethyl-indeno[1,2-c]pyrazol-1-yl)propan-2-amine
IUPAC Name: (2S)-1-(7-methoxy-4,4-dimethylindeno[1,2-c]pyrazol-1-yl)propan-2-amine
SYSTEMATIC NAME: (2S)-1-(7-methoxy-4,4-dimethyl-indeno[1,2-c]pyrazol-1-yl)propan-2-amine
MOLECULAR FORMULA: C16H21N3O
MOLECULAR WEIGHT: 271.35744
SMILES: C[C@@H](CN1C2=C(C=N1)C(C3=C2C=C(C=C3)OC)(C)C)N
Structure:
CAS RN: 176721-27-0
CAS Name: 1-(7-methyl-4H-indeno[1,2-c]pyrazol-1-yl)-2-propanamine
OPENEYE Name: 1-(7-methyl-4H-indeno[1,2-c]pyrazol-1-yl)propan-2-amine
IUPAC Name: 1-(7-methyl-4H-indeno[1,2-c]pyrazol-1-yl)propan-2-amine
SYSTEMATIC NAME: 1-(7-methyl-4H-indeno[1,2-c]pyrazol-1-yl)propan-2-amine
MOLECULAR FORMULA: C14H17N3
MOLECULAR WEIGHT: 227.30488
SMILES: CC1=CC2=C(CC3=C2N(N=C3)CC(C)N)C=C1
Structure:
CAS RN: 176721-35-0
CAS Name: 1-(8-methoxy-4,5-dihydrobenzo[g]indazol-1-yl)-2-propanamine
OPENEYE Name: 1-(8-methoxy-4,5-dihydrobenzo[g]indazol-1-yl)propan-2-amine
IUPAC Name: 1-(8-methoxy-4,5-dihydrobenzo[g]indazol-1-yl)propan-2-amine
SYSTEMATIC NAME: 1-(8-methoxy-4,5-dihydrobenzo[g]indazol-1-yl)propan-2-amine
MOLECULAR FORMULA: C15H19N3O
MOLECULAR WEIGHT: 257.33086
SMILES: CC(CN1C2=C(CCC3=C2C=C(C=C3)OC)C=N1)N
Structure:
CAS RN: 372163-84-3
CAS Name: (2S)-1-(7-ethyl-1-furo[2,3-g]indazolyl)-2-propanamine
OPENEYE Name: (2S)-1-(7-ethylfuro[2,3-g]indazol-1-yl)propan-2-amine
IUPAC Name: (2S)-1-(7-ethylfuro[2,3-g]indazol-1-yl)propan-2-amine
SYSTEMATIC NAME: (2S)-1-(7-ethylfuro[2,3-g]indazol-1-yl)propan-2-amine
MOLECULAR FORMULA: C14H17N3O
MOLECULAR WEIGHT: 243.30428
SMILES: CCC1=CC2=C(O1)C=CC3=C2N(N=C3)C[C@H](C)N
Structure:
CAS RN: 176721-37-2
CAS Name: 1-(8-methoxy-1-benzo[g]indazolyl)-2-propanamine
OPENEYE Name: 1-(8-methoxybenzo[g]indazol-1-yl)propan-2-amine
IUPAC Name: 1-(8-methoxybenzo[g]indazol-1-yl)propan-2-amine
SYSTEMATIC NAME: 1-(8-methoxybenzo[g]indazol-1-yl)propan-2-amine
MOLECULAR FORMULA: C15H17N3O
MOLECULAR WEIGHT: 255.31498
SMILES: CC(CN1C2=C(C=CC3=C2C=C(C=C3)OC)C=N1)N
Structure:
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