Organoheterocyclic compounds
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Naftopidil hydrochloride, 98+%, Thermo Scientific Chemicals
CAS: 1164469-60-6 Molecular Formula: C24H29ClN2O3 Molecular Weight (g/mol): 428.957 MDL Number: MFCD09971016 InChI Key: VQAAEWMEVIOHTJ-UHFFFAOYSA-N Synonym: naftopidil hydrochloride,opera_id_518,1-4-2-methoxyphenyl piperazin-1-yl-3-naphthalen-1-yloxypropan-2-ol hydrochloride,4-2-methoxyphenyl-?-1-naphthalenyloxy methyl-1-piperazineethanol hydrochloride PubChem CID: 6603044 IUPAC Name: 1-[4-(2-methoxyphenyl)piperazin-1-yl]-3-naphthalen-1-yloxypropan-2-ol;hydrochloride SMILES: COC1=CC=CC=C1N2CCN(CC2)CC(COC3=CC=CC4=CC=CC=C43)O.Cl
| PubChem CID | 6603044 |
|---|---|
| CAS | 1164469-60-6 |
| Molecular Weight (g/mol) | 428.957 |
| MDL Number | MFCD09971016 |
| SMILES | COC1=CC=CC=C1N2CCN(CC2)CC(COC3=CC=CC4=CC=CC=C43)O.Cl |
| Synonym | naftopidil hydrochloride,opera_id_518,1-4-2-methoxyphenyl piperazin-1-yl-3-naphthalen-1-yloxypropan-2-ol hydrochloride,4-2-methoxyphenyl-?-1-naphthalenyloxy methyl-1-piperazineethanol hydrochloride |
| IUPAC Name | 1-[4-(2-methoxyphenyl)piperazin-1-yl]-3-naphthalen-1-yloxypropan-2-ol;hydrochloride |
| InChI Key | VQAAEWMEVIOHTJ-UHFFFAOYSA-N |
| Molecular Formula | C24H29ClN2O3 |
6-Methyl-3(2H)-pyridazinone, 98%
CAS: 13327-27-0 Molecular Formula: C5H6N2O Molecular Weight (g/mol): 110.12 MDL Number: MFCD00039720 InChI Key: QZWIXLPWMGHDDD-UHFFFAOYSA-N Synonym: 6-methylpyridazin-3 2h-one,6-methyl-3 2h-pyridazinone,6-methylpyridazin-3-ol,6-methyl-2h-pyridazin-3-one,6-methyl-3-pyridazinone,3-hydroxy-6-methylpyridazine,3 2h-pyridazinone, 6-methyl,6-methyl-2,3-dihydropyridazin-3-one,6me3oxopyridaz PubChem CID: 83346 IUPAC Name: 3-methyl-1H-pyridazin-6-one SMILES: CC1=NNC(=O)C=C1
| PubChem CID | 83346 |
|---|---|
| CAS | 13327-27-0 |
| Molecular Weight (g/mol) | 110.12 |
| MDL Number | MFCD00039720 |
| SMILES | CC1=NNC(=O)C=C1 |
| Synonym | 6-methylpyridazin-3 2h-one,6-methyl-3 2h-pyridazinone,6-methylpyridazin-3-ol,6-methyl-2h-pyridazin-3-one,6-methyl-3-pyridazinone,3-hydroxy-6-methylpyridazine,3 2h-pyridazinone, 6-methyl,6-methyl-2,3-dihydropyridazin-3-one,6me3oxopyridaz |
| IUPAC Name | 3-methyl-1H-pyridazin-6-one |
| InChI Key | QZWIXLPWMGHDDD-UHFFFAOYSA-N |
| Molecular Formula | C5H6N2O |
6-methyl-2,3-dihydropyridazin-3-one hydrate, Thermo Scientific™
CAS: 7143-82-0 Molecular Formula: C5H6N2O Molecular Weight (g/mol): 110.12 MDL Number: MFCD00039720 InChI Key: QZWIXLPWMGHDDD-UHFFFAOYSA-N Synonym: 6-methylpyridazin-3-ol hydrate,6-methylpyridazin-3 2h-one hydrate,6-methyl-2,3-dihydropyridazin-3-one hydrate,6-methyl-2h-pyridazin-3-one hydrate,6-methylpyridazin-3-one hydrate,3-methyl-1h-pyridazin-6-one hydrate,6-methylpyridazin-3 2h ;-one hydrate,6-methyl-2-hydropyridazin-3-one, hydrate,6-methyl-2,3-dihydropyridazine-3-one hydrate,6-methylpyridazin-3 2h-one-water 1/1 PubChem CID: 2774632 SMILES: CC1=NNC(=O)C=C1
| PubChem CID | 2774632 |
|---|---|
| CAS | 7143-82-0 |
| Molecular Weight (g/mol) | 110.12 |
| MDL Number | MFCD00039720 |
| SMILES | CC1=NNC(=O)C=C1 |
| Synonym | 6-methylpyridazin-3-ol hydrate,6-methylpyridazin-3 2h-one hydrate,6-methyl-2,3-dihydropyridazin-3-one hydrate,6-methyl-2h-pyridazin-3-one hydrate,6-methylpyridazin-3-one hydrate,3-methyl-1h-pyridazin-6-one hydrate,6-methylpyridazin-3 2h ;-one hydrate,6-methyl-2-hydropyridazin-3-one, hydrate,6-methyl-2,3-dihydropyridazine-3-one hydrate,6-methylpyridazin-3 2h-one-water 1/1 |
| InChI Key | QZWIXLPWMGHDDD-UHFFFAOYSA-N |
| Molecular Formula | C5H6N2O |
4,5-Dichloro-2-methyl-3(2H)-pyridazinone, 97%, Thermo Scientific Chemicals
CAS: 933-76-6 Molecular Formula: C5H4Cl2N2O Molecular Weight (g/mol): 179.00 MDL Number: MFCD00051686 InChI Key: ACKBTCUMGAHRIE-UHFFFAOYSA-N Synonym: 4,5-dichloro-2-methylpyridazin-3 2h-one,4,5-dichloro-2-methyl-3 2h-pyridazinone,3 2h-pyridazinone, 4,5-dichloro-2-methyl,4,5-dichloro-2-methyl-2h-pyridazin-3-one,4,5-dichloro-2-methyl-2,3-dihydropyridazin-3-one,3 2h-pyridazinone,4,5-dichloro-2-methyl,4,5-dichloro-2-methyl-2-hydropyridazin-3-one,pubchem16243,acmc-209wiz,5-24-02-00023 beilstein handbook reference PubChem CID: 120462 IUPAC Name: 4,5-dichloro-2-methylpyridazin-3-one SMILES: CN1N=CC(Cl)=C(Cl)C1=O
| PubChem CID | 120462 |
|---|---|
| CAS | 933-76-6 |
| Molecular Weight (g/mol) | 179.00 |
| MDL Number | MFCD00051686 |
| SMILES | CN1N=CC(Cl)=C(Cl)C1=O |
| Synonym | 4,5-dichloro-2-methylpyridazin-3 2h-one,4,5-dichloro-2-methyl-3 2h-pyridazinone,3 2h-pyridazinone, 4,5-dichloro-2-methyl,4,5-dichloro-2-methyl-2h-pyridazin-3-one,4,5-dichloro-2-methyl-2,3-dihydropyridazin-3-one,3 2h-pyridazinone,4,5-dichloro-2-methyl,4,5-dichloro-2-methyl-2-hydropyridazin-3-one,pubchem16243,acmc-209wiz,5-24-02-00023 beilstein handbook reference |
| IUPAC Name | 4,5-dichloro-2-methylpyridazin-3-one |
| InChI Key | ACKBTCUMGAHRIE-UHFFFAOYSA-N |
| Molecular Formula | C5H4Cl2N2O |
Adenine, Synthetic, Spectrum™ Chemical
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CAS: 73-24-5
| CAS | 73-24-5 |
|---|
4-chloro-1,2-dihydrophthalazin-1-one, 97%, Thermo Scientific™
CAS: 2257-69-4 Molecular Formula: C8H5ClN2O Molecular Weight (g/mol): 180.59 MDL Number: MFCD00102192 InChI Key: QCKGMJDOJRNSMS-UHFFFAOYSA-N Synonym: 4-chlorophthalazin-1 2h-one,4-chloro-1,2-dihydrophthalazin-1-one,4-chlorophthalazin-1-ol,1 2h-phthalazinone, 4-chloro,4-chloro-1 2h-phthalazinone,4-chlorophthalazone,4-chloro-1-phthalazinol,4-chlorophthalazin-1-one,1-chlorophthalazin-4-one,1-chlorophthalazine-4-one PubChem CID: 2775142 IUPAC Name: 4-chloro-2H-phthalazin-1-one SMILES: ClC1=NNC(=O)C2=CC=CC=C12
| PubChem CID | 2775142 |
|---|---|
| CAS | 2257-69-4 |
| Molecular Weight (g/mol) | 180.59 |
| MDL Number | MFCD00102192 |
| SMILES | ClC1=NNC(=O)C2=CC=CC=C12 |
| Synonym | 4-chlorophthalazin-1 2h-one,4-chloro-1,2-dihydrophthalazin-1-one,4-chlorophthalazin-1-ol,1 2h-phthalazinone, 4-chloro,4-chloro-1 2h-phthalazinone,4-chlorophthalazone,4-chloro-1-phthalazinol,4-chlorophthalazin-1-one,1-chlorophthalazin-4-one,1-chlorophthalazine-4-one |
| IUPAC Name | 4-chloro-2H-phthalazin-1-one |
| InChI Key | QCKGMJDOJRNSMS-UHFFFAOYSA-N |
| Molecular Formula | C8H5ClN2O |
3-Aminopyridazine, 97%
CAS: 5469-70-5 Molecular Formula: C4H5N3 Molecular Weight (g/mol): 95.105 MDL Number: MFCD01529869 InChI Key: LETVJWLLIMJADE-UHFFFAOYSA-N Synonym: 3-aminopyridazine,3-pyridazinamine,aminopyridazine,pyridazin-3-ylamine,3-amino-1,2-diazine,pyridazine-3-ylamine,pyridazineamine,pyridazyl amine,imino-pyridazine,3-pyridazinamin PubChem CID: 230373 IUPAC Name: pyridazin-3-amine SMILES: C1=CC(=NN=C1)N
| PubChem CID | 230373 |
|---|---|
| CAS | 5469-70-5 |
| Molecular Weight (g/mol) | 95.105 |
| MDL Number | MFCD01529869 |
| SMILES | C1=CC(=NN=C1)N |
| Synonym | 3-aminopyridazine,3-pyridazinamine,aminopyridazine,pyridazin-3-ylamine,3-amino-1,2-diazine,pyridazine-3-ylamine,pyridazineamine,pyridazyl amine,imino-pyridazine,3-pyridazinamin |
| IUPAC Name | pyridazin-3-amine |
| InChI Key | LETVJWLLIMJADE-UHFFFAOYSA-N |
| Molecular Formula | C4H5N3 |
1,4-Bis(2-hydroxyethyl)piperazine, 98%
CAS: 122-96-3 Molecular Formula: C8H18N2O2 Molecular Weight (g/mol): 174.244 MDL Number: MFCD00006157 InChI Key: VARKIGWTYBUWNT-UHFFFAOYSA-N Synonym: 1,4-piperazinediethanol,2,2'-piperazine-1,4-diyl diethanol,1,4-bis 2-hydroxyethyl piperazine,n,n'-bis 2-hydroxyethyl piperazine,1,4-di 2-hydroxyethyl piperazine,n,n'-dihydroxyethylpiperazine,n,n'-di 2-hydroxyethyl piperazine,unii-eq349pkx8y,piperazine, n,n'-bis 2-hydroxyethyl,1,4-bis beta-hydroxyethyl piperazine PubChem CID: 67151 IUPAC Name: 2-[4-(2-hydroxyethyl)piperazin-1-yl]ethanol SMILES: C1CN(CCN1CCO)CCO
| PubChem CID | 67151 |
|---|---|
| CAS | 122-96-3 |
| Molecular Weight (g/mol) | 174.244 |
| MDL Number | MFCD00006157 |
| SMILES | C1CN(CCN1CCO)CCO |
| Synonym | 1,4-piperazinediethanol,2,2'-piperazine-1,4-diyl diethanol,1,4-bis 2-hydroxyethyl piperazine,n,n'-bis 2-hydroxyethyl piperazine,1,4-di 2-hydroxyethyl piperazine,n,n'-dihydroxyethylpiperazine,n,n'-di 2-hydroxyethyl piperazine,unii-eq349pkx8y,piperazine, n,n'-bis 2-hydroxyethyl,1,4-bis beta-hydroxyethyl piperazine |
| IUPAC Name | 2-[4-(2-hydroxyethyl)piperazin-1-yl]ethanol |
| InChI Key | VARKIGWTYBUWNT-UHFFFAOYSA-N |
| Molecular Formula | C8H18N2O2 |
4-Aminophthalhydrazide, 98%
CAS: 3682-14-2 Molecular Formula: C8H7N3O2 Molecular Weight (g/mol): 177.16 MDL Number: MFCD00010560 InChI Key: HUDPLKWXRLNSPC-UHFFFAOYSA-N Synonym: 4-aminophthalhydrazide,isoluminol,6-aminophthalazine-1,4-diol,chembl14882,1,4-phthalazinedione, 6-amino-2,3-dihydro,6-amino-2,3-dihydro-1,4-phthalazinedione,iso-luminol,1enu,4-aminophthaloylhydrazine,4-amino-phthalsaeure-hydrazid PubChem CID: 95014 SMILES: NC1=CC=C2C(=O)NNC(=O)C2=C1
| PubChem CID | 95014 |
|---|---|
| CAS | 3682-14-2 |
| Molecular Weight (g/mol) | 177.16 |
| MDL Number | MFCD00010560 |
| SMILES | NC1=CC=C2C(=O)NNC(=O)C2=C1 |
| Synonym | 4-aminophthalhydrazide,isoluminol,6-aminophthalazine-1,4-diol,chembl14882,1,4-phthalazinedione, 6-amino-2,3-dihydro,6-amino-2,3-dihydro-1,4-phthalazinedione,iso-luminol,1enu,4-aminophthaloylhydrazine,4-amino-phthalsaeure-hydrazid |
| InChI Key | HUDPLKWXRLNSPC-UHFFFAOYSA-N |
| Molecular Formula | C8H7N3O2 |
6-Bromophthalazin-1(4H)-one, 98%
CAS: 75884-70-7 Molecular Formula: C8H5BrN2O Molecular Weight (g/mol): 225.05 MDL Number: MFCD09264003 InChI Key: QMONLZVJOOMKRW-UHFFFAOYSA-N PubChem CID: 11535918 IUPAC Name: 6-bromo-1,2-dihydrophthalazin-1-one SMILES: BrC1=CC=C2C(=O)NN=CC2=C1
| PubChem CID | 11535918 |
|---|---|
| CAS | 75884-70-7 |
| Molecular Weight (g/mol) | 225.05 |
| MDL Number | MFCD09264003 |
| SMILES | BrC1=CC=C2C(=O)NN=CC2=C1 |
| IUPAC Name | 6-bromo-1,2-dihydrophthalazin-1-one |
| InChI Key | QMONLZVJOOMKRW-UHFFFAOYSA-N |
| Molecular Formula | C8H5BrN2O |
3-Phenylcinnoline-4-carboxylic acid, 97%, Thermo Scientific™
CAS: 10604-21-4 Molecular Formula: C15H10N2O2 Molecular Weight (g/mol): 250.257 MDL Number: MFCD00219795 InChI Key: UGJHDXUWDLKCDG-UHFFFAOYSA-N Synonym: 4-cinnolinecarboxylicacid, 3-phenyl,maybridge1_004872,3-phenyl-cinnoline-4-carboxylic acid PubChem CID: 5709072 IUPAC Name: 3-phenylcinnoline-4-carboxylic acid SMILES: C1=CC=C(C=C1)C2=C(C3=CC=CC=C3N=N2)C(=O)O
| PubChem CID | 5709072 |
|---|---|
| CAS | 10604-21-4 |
| Molecular Weight (g/mol) | 250.257 |
| MDL Number | MFCD00219795 |
| SMILES | C1=CC=C(C=C1)C2=C(C3=CC=CC=C3N=N2)C(=O)O |
| Synonym | 4-cinnolinecarboxylicacid, 3-phenyl,maybridge1_004872,3-phenyl-cinnoline-4-carboxylic acid |
| IUPAC Name | 3-phenylcinnoline-4-carboxylic acid |
| InChI Key | UGJHDXUWDLKCDG-UHFFFAOYSA-N |
| Molecular Formula | C15H10N2O2 |
6-chloropyridazin-3-amine, Thermo Scientific™, 97%, Thermo Scientific™
CAS: 5469-69-2 Molecular Formula: C4H4ClN3 Molecular Weight (g/mol): 129.55 MDL Number: MFCD00051506 InChI Key: DTXVKPOKPFWSFF-UHFFFAOYSA-N Synonym: 3-amino-6-chloropyridazine,3-pyridazinamine, 6-chloro,6-chloro-3-pyridazinamine,6-amino-3-chloropyridazine,6-chloro-3-aminopyridazine,6-chloropyridazin-3-ylamine,6-chloro-pyridazin-3-ylamine,unii-ijs443slzg,3-chloro-6-pyridazinamine,6-chloro-3-pyridazinylamine PubChem CID: 21643 IUPAC Name: 6-chloropyridazin-3-amine SMILES: NC1=CC=C(Cl)N=N1
| PubChem CID | 21643 |
|---|---|
| CAS | 5469-69-2 |
| Molecular Weight (g/mol) | 129.55 |
| MDL Number | MFCD00051506 |
| SMILES | NC1=CC=C(Cl)N=N1 |
| Synonym | 3-amino-6-chloropyridazine,3-pyridazinamine, 6-chloro,6-chloro-3-pyridazinamine,6-amino-3-chloropyridazine,6-chloro-3-aminopyridazine,6-chloropyridazin-3-ylamine,6-chloro-pyridazin-3-ylamine,unii-ijs443slzg,3-chloro-6-pyridazinamine,6-chloro-3-pyridazinylamine |
| IUPAC Name | 6-chloropyridazin-3-amine |
| InChI Key | DTXVKPOKPFWSFF-UHFFFAOYSA-N |
| Molecular Formula | C4H4ClN3 |
2-(4-Methylpiperazino)benzaldehyde, ≥95%, Thermo Scientific™
CAS: 85803-62-9 Molecular Formula: C12H16N2O Molecular Weight (g/mol): 204.273 MDL Number: MFCD01313808 InChI Key: GSRYZPWIWYYROI-UHFFFAOYSA-N Synonym: 2-4-methylpiperazin-1-yl benzaldehyde,2-4-methylpiperazino benzaldehyde,benzaldehyde,2-4-methyl-1-piperazinyl,4-methylpiperazin-1-ylbenzaldehyde,2-4-methylpiperazinyl benzaldehyde,2-4-methylpiperazinyl-benzaldehyde,2-4-methyl-1-piperazinyl benzaldehyde,2-4methyl-1-piperazinyl-benzaldehyde,2-4-methyl-1-piperazinyl-benzaldehyde,2-4-methylpiperazin-1-yl-benzaldehyde PubChem CID: 2795566 IUPAC Name: 2-(4-methylpiperazin-1-yl)benzaldehyde SMILES: CN1CCN(CC1)C2=CC=CC=C2C=O
| PubChem CID | 2795566 |
|---|---|
| CAS | 85803-62-9 |
| Molecular Weight (g/mol) | 204.273 |
| MDL Number | MFCD01313808 |
| SMILES | CN1CCN(CC1)C2=CC=CC=C2C=O |
| Synonym | 2-4-methylpiperazin-1-yl benzaldehyde,2-4-methylpiperazino benzaldehyde,benzaldehyde,2-4-methyl-1-piperazinyl,4-methylpiperazin-1-ylbenzaldehyde,2-4-methylpiperazinyl benzaldehyde,2-4-methylpiperazinyl-benzaldehyde,2-4-methyl-1-piperazinyl benzaldehyde,2-4methyl-1-piperazinyl-benzaldehyde,2-4-methyl-1-piperazinyl-benzaldehyde,2-4-methylpiperazin-1-yl-benzaldehyde |
| IUPAC Name | 2-(4-methylpiperazin-1-yl)benzaldehyde |
| InChI Key | GSRYZPWIWYYROI-UHFFFAOYSA-N |
| Molecular Formula | C12H16N2O |
4-Chloro-6-methylpyrimidine, 97%
CAS: 3435-25-4 Molecular Formula: C5H5ClN2 Molecular Weight (g/mol): 128.559 MDL Number: MFCD02322991 InChI Key: MVAXKFAQKTWRAH-UHFFFAOYSA-N Synonym: 4-methyl-6-chloro pyrimidine,4-methyl-6-chloropyrimidine,pyrimidine, 4-chloro-6-methyl,4-chloro-6-methyl-pyrimidine,6-chloro-4-methylpyrimidine,4-chloro-6-methyl-1,3-diazine,pubchem13240,6-methyl-4-chloropyrimidin,ksc269g3h,pyrimidine, 4-chloro-6-methyl-6ci,7ci,8ci,9ci PubChem CID: 581796 IUPAC Name: 4-chloro-6-methylpyrimidine SMILES: CC1=CC(=NC=N1)Cl
| PubChem CID | 581796 |
|---|---|
| CAS | 3435-25-4 |
| Molecular Weight (g/mol) | 128.559 |
| MDL Number | MFCD02322991 |
| SMILES | CC1=CC(=NC=N1)Cl |
| Synonym | 4-methyl-6-chloro pyrimidine,4-methyl-6-chloropyrimidine,pyrimidine, 4-chloro-6-methyl,4-chloro-6-methyl-pyrimidine,6-chloro-4-methylpyrimidine,4-chloro-6-methyl-1,3-diazine,pubchem13240,6-methyl-4-chloropyrimidin,ksc269g3h,pyrimidine, 4-chloro-6-methyl-6ci,7ci,8ci,9ci |
| IUPAC Name | 4-chloro-6-methylpyrimidine |
| InChI Key | MVAXKFAQKTWRAH-UHFFFAOYSA-N |
| Molecular Formula | C5H5ClN2 |
4-Amino-5-bromopyrimidine, 98%
CAS: 1439-10-7 Molecular Formula: C4H4BrN3 Molecular Weight (g/mol): 174.001 MDL Number: MFCD00233962 InChI Key: IIFAONYUCDAVGA-UHFFFAOYSA-N PubChem CID: 10261576 IUPAC Name: 5-bromopyrimidin-4-amine SMILES: C1=C(C(=NC=N1)N)Br
| PubChem CID | 10261576 |
|---|---|
| CAS | 1439-10-7 |
| Molecular Weight (g/mol) | 174.001 |
| MDL Number | MFCD00233962 |
| SMILES | C1=C(C(=NC=N1)N)Br |
| IUPAC Name | 5-bromopyrimidin-4-amine |
| InChI Key | IIFAONYUCDAVGA-UHFFFAOYSA-N |
| Molecular Formula | C4H4BrN3 |