Organoheterocyclic compounds
Filtered Search Results
Lovastatin, 97%
CAS: 75330-75-5 Molecular Formula: C24H36O5 Molecular Weight (g/mol): 404.55 MDL Number: MFCD00072164 InChI Key: PCZOHLXUXFIOCF-BXMDZJJMSA-N Synonym: lovastatin,mevinolin,mevacor,monacolin k,lovalip,altoprev,lovalord,mevinacor,nergadan,6alpha-methylcompactin PubChem CID: 53232 ChEBI: CHEBI:40303 IUPAC Name: (1S,3R,7S,8S,8aR)-8-{2-[(2R,4R)-4-hydroxy-6-oxooxan-2-yl]ethyl}-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl (2S)-2-methylbutanoate SMILES: CC[C@H](C)C(=O)O[C@H]1C[C@@H](C)C=C2C=C[C@H](C)[C@H](CC[C@@H]3C[C@@H](O)CC(=O)O3)[C@@H]12
| PubChem CID | 53232 |
|---|---|
| CAS | 75330-75-5 |
| Molecular Weight (g/mol) | 404.55 |
| ChEBI | CHEBI:40303 |
| MDL Number | MFCD00072164 |
| SMILES | CC[C@H](C)C(=O)O[C@H]1C[C@@H](C)C=C2C=C[C@H](C)[C@H](CC[C@@H]3C[C@@H](O)CC(=O)O3)[C@@H]12 |
| Synonym | lovastatin,mevinolin,mevacor,monacolin k,lovalip,altoprev,lovalord,mevinacor,nergadan,6alpha-methylcompactin |
| IUPAC Name | (1S,3R,7S,8S,8aR)-8-{2-[(2R,4R)-4-hydroxy-6-oxooxan-2-yl]ethyl}-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl (2S)-2-methylbutanoate |
| InChI Key | PCZOHLXUXFIOCF-BXMDZJJMSA-N |
| Molecular Formula | C24H36O5 |
1-Boc-piperazine, 99%
CAS: 57260-71-6 Molecular Formula: C9H19N2O2 Molecular Weight (g/mol): 187.26 MDL Number: MFCD00075265 InChI Key: CWXPZXBSDSIRCS-UHFFFAOYSA-O Synonym: 1-boc-piperazine,n-boc-piperazine,1-n-boc-piperazine,tert-butyl 1-piperazinecarboxylate,1-tert-butoxycarbonyl piperazine,n-t-butoxycarbonylpiperazine,boc-piperazine,n-tert-butoxycarbonylpiperazine,piperazine-1-carboxylic acid tert-butyl ester,1-piperazinecarboxylic acid, 1,1-dimethylethyl ester PubChem CID: 143452 IUPAC Name: tert-butyl piperazine-1-carboxylate SMILES: CC(C)(C)OC(=O)N1CC[NH2+]CC1
| PubChem CID | 143452 |
|---|---|
| CAS | 57260-71-6 |
| Molecular Weight (g/mol) | 187.26 |
| MDL Number | MFCD00075265 |
| SMILES | CC(C)(C)OC(=O)N1CC[NH2+]CC1 |
| Synonym | 1-boc-piperazine,n-boc-piperazine,1-n-boc-piperazine,tert-butyl 1-piperazinecarboxylate,1-tert-butoxycarbonyl piperazine,n-t-butoxycarbonylpiperazine,boc-piperazine,n-tert-butoxycarbonylpiperazine,piperazine-1-carboxylic acid tert-butyl ester,1-piperazinecarboxylic acid, 1,1-dimethylethyl ester |
| IUPAC Name | tert-butyl piperazine-1-carboxylate |
| InChI Key | CWXPZXBSDSIRCS-UHFFFAOYSA-O |
| Molecular Formula | C9H19N2O2 |
Nalidixic acid sodium salt, 98.1%, MP Biomedicals™
CAS: 389-08-2 Molecular Formula: C12H12N2O3 Molecular Weight (g/mol): 232.239 InChI Key: MHWLWQUZZRMNGJ-UHFFFAOYSA-N Synonym: nalidixic acid,nalidixin,nevigramon,nalidixate,uronidix,innoxalon,nalidixan,nalitucsan,sicmylon,unaserus PubChem CID: 4421 ChEBI: CHEBI:100147 IUPAC Name: 1-ethyl-7-methyl-4-oxo-1,8-naphthyridine-3-carboxylic acid SMILES: CCN1C=C(C(=O)C2=C1N=C(C=C2)C)C(=O)O
| PubChem CID | 4421 |
|---|---|
| CAS | 389-08-2 |
| Molecular Weight (g/mol) | 232.239 |
| ChEBI | CHEBI:100147 |
| SMILES | CCN1C=C(C(=O)C2=C1N=C(C=C2)C)C(=O)O |
| Synonym | nalidixic acid,nalidixin,nevigramon,nalidixate,uronidix,innoxalon,nalidixan,nalitucsan,sicmylon,unaserus |
| IUPAC Name | 1-ethyl-7-methyl-4-oxo-1,8-naphthyridine-3-carboxylic acid |
| InChI Key | MHWLWQUZZRMNGJ-UHFFFAOYSA-N |
| Molecular Formula | C12H12N2O3 |
4-Vinylpyridine, 95%, stab. with 80 to 150ppm hydroquinone
CAS: 100-43-6 Molecular Formula: C7H7N Molecular Weight (g/mol): 105.14 MDL Number: MFCD00006447 InChI Key: KFDVPJUYSDEJTH-UHFFFAOYSA-N Synonym: 4-vinylpyridine,pyridine, 4-ethenyl,pyridine, 4-vinyl,gamma-vinylpyridine,unii-i56g67xm8d,ccris 5240,4vp,4-pyridylethylene,4-vinyl-pyridine,4-vinyl pyridine PubChem CID: 7502 IUPAC Name: 4-ethenylpyridine SMILES: C=CC1=CC=NC=C1
| PubChem CID | 7502 |
|---|---|
| CAS | 100-43-6 |
| Molecular Weight (g/mol) | 105.14 |
| MDL Number | MFCD00006447 |
| SMILES | C=CC1=CC=NC=C1 |
| Synonym | 4-vinylpyridine,pyridine, 4-ethenyl,pyridine, 4-vinyl,gamma-vinylpyridine,unii-i56g67xm8d,ccris 5240,4vp,4-pyridylethylene,4-vinyl-pyridine,4-vinyl pyridine |
| IUPAC Name | 4-ethenylpyridine |
| InChI Key | KFDVPJUYSDEJTH-UHFFFAOYSA-N |
| Molecular Formula | C7H7N |
Theobromine, 99%
CAS: 83-67-0 Molecular Formula: C7H8N4O2 Molecular Weight (g/mol): 180.167 MDL Number: MFCD00022830 InChI Key: YAPQBXQYLJRXSA-UHFFFAOYSA-N Synonym: theobromine,3,7-dimethylxanthine,diurobromine,teobromin,theosalvose,theostene,santheose,thesodate,thesal,theobromin PubChem CID: 5429 ChEBI: CHEBI:28946 IUPAC Name: 3,7-dimethylpurine-2,6-dione SMILES: CN1C=NC2=C1C(=O)NC(=O)N2C
| PubChem CID | 5429 |
|---|---|
| CAS | 83-67-0 |
| Molecular Weight (g/mol) | 180.167 |
| ChEBI | CHEBI:28946 |
| MDL Number | MFCD00022830 |
| SMILES | CN1C=NC2=C1C(=O)NC(=O)N2C |
| Synonym | theobromine,3,7-dimethylxanthine,diurobromine,teobromin,theosalvose,theostene,santheose,thesodate,thesal,theobromin |
| IUPAC Name | 3,7-dimethylpurine-2,6-dione |
| InChI Key | YAPQBXQYLJRXSA-UHFFFAOYSA-N |
| Molecular Formula | C7H8N4O2 |
2-Phenylbenzimidazole-5-sulfonic acid, 98%
CAS: 27503-81-7 Molecular Formula: C13H10N2O3S Molecular Weight (g/mol): 274.29 MDL Number: MFCD00053007 InChI Key: UVCJGUGAGLDPAA-UHFFFAOYSA-N Synonym: ensulizole,2-phenylbenzimidazole-5-sulfonic acid,phenylbenzimidazole sulfonic acid,2-phenyl-1h-benzo d imidazole-5-sulfonic acid,2-phenyl-1h-benzo d imidazole-6-sulfonic acid,1h-benzimidazole-5-sulfonic acid, 2-phenyl,unii-9yq9di1w42,2-phenyl-1h-benzimidazole-5-sulfonic acid,parsol hs,2-phenyl-5-benzimidazolesulfonic acid PubChem CID: 33919 IUPAC Name: 2-phenyl-3H-benzimidazole-5-sulfonic acid SMILES: OS(=O)(=O)C1=CC=C2N=C(NC2=C1)C1=CC=CC=C1
| PubChem CID | 33919 |
|---|---|
| CAS | 27503-81-7 |
| Molecular Weight (g/mol) | 274.29 |
| MDL Number | MFCD00053007 |
| SMILES | OS(=O)(=O)C1=CC=C2N=C(NC2=C1)C1=CC=CC=C1 |
| Synonym | ensulizole,2-phenylbenzimidazole-5-sulfonic acid,phenylbenzimidazole sulfonic acid,2-phenyl-1h-benzo d imidazole-5-sulfonic acid,2-phenyl-1h-benzo d imidazole-6-sulfonic acid,1h-benzimidazole-5-sulfonic acid, 2-phenyl,unii-9yq9di1w42,2-phenyl-1h-benzimidazole-5-sulfonic acid,parsol hs,2-phenyl-5-benzimidazolesulfonic acid |
| IUPAC Name | 2-phenyl-3H-benzimidazole-5-sulfonic acid |
| InChI Key | UVCJGUGAGLDPAA-UHFFFAOYSA-N |
| Molecular Formula | C13H10N2O3S |
Disuccinimidyl suberate, 97%
CAS: 68528-80-3 Molecular Formula: C16H20N2O8 Molecular Weight (g/mol): 368.342 MDL Number: MFCD00049059 InChI Key: ZWIBGKZDAWNIFC-UHFFFAOYSA-N Synonym: disuccinimidyl suberate,bis 2,5-dioxopyrrolidin-1-yl octanedioate,suberic acid bis n-hydroxysuccinimide ester,di n-succinimidyl suberate,bicl100,2,5-pyrrolidinedione, 1,1'-1,8-dioxo-1,8-octanediyl bis oxy bis,nhs-sa,disuccinimidylsuberate,dsis,n-hydroxysuccinimide suberic acid ester PubChem CID: 100658 IUPAC Name: bis(2,5-dioxopyrrolidin-1-yl) octanedioate SMILES: C1CC(=O)N(C1=O)OC(=O)CCCCCCC(=O)ON2C(=O)CCC2=O
| PubChem CID | 100658 |
|---|---|
| CAS | 68528-80-3 |
| Molecular Weight (g/mol) | 368.342 |
| MDL Number | MFCD00049059 |
| SMILES | C1CC(=O)N(C1=O)OC(=O)CCCCCCC(=O)ON2C(=O)CCC2=O |
| Synonym | disuccinimidyl suberate,bis 2,5-dioxopyrrolidin-1-yl octanedioate,suberic acid bis n-hydroxysuccinimide ester,di n-succinimidyl suberate,bicl100,2,5-pyrrolidinedione, 1,1'-1,8-dioxo-1,8-octanediyl bis oxy bis,nhs-sa,disuccinimidylsuberate,dsis,n-hydroxysuccinimide suberic acid ester |
| IUPAC Name | bis(2,5-dioxopyrrolidin-1-yl) octanedioate |
| InChI Key | ZWIBGKZDAWNIFC-UHFFFAOYSA-N |
| Molecular Formula | C16H20N2O8 |
6-Mercaptopurine monohydrate, 98%
CAS: 6112-76-1 Molecular Formula: C5H6N4OS Molecular Weight (g/mol): 170.19 MDL Number: MFCD03854445,MFCD01461928 InChI Key: WFFQYWAAEWLHJC-UHFFFAOYSA-N Synonym: 6-mercaptopurine monohydrate,6-mercaptopurine hydrate,mercaptopurine monohydrate,mercaptopurine hydrate,6h-purine-6-thione, 1,7-dihydro-, monohydrate,6,7-dihydro-3h-purine-6-thione hydrate,purine-6-thiol monohydrate,1,7-dihydro-6h-purine-6-thione monohydrate,purine-6-thiol, monohydrate,unii-e7wed276i5 PubChem CID: 2724350 ChEBI: CHEBI:31822 IUPAC Name: 3,7-dihydropurine-6-thione;hydrate SMILES: O.S=C1N=CNC2=C1NC=N2
| PubChem CID | 2724350 |
|---|---|
| CAS | 6112-76-1 |
| Molecular Weight (g/mol) | 170.19 |
| ChEBI | CHEBI:31822 |
| MDL Number | MFCD03854445,MFCD01461928 |
| SMILES | O.S=C1N=CNC2=C1NC=N2 |
| Synonym | 6-mercaptopurine monohydrate,6-mercaptopurine hydrate,mercaptopurine monohydrate,mercaptopurine hydrate,6h-purine-6-thione, 1,7-dihydro-, monohydrate,6,7-dihydro-3h-purine-6-thione hydrate,purine-6-thiol monohydrate,1,7-dihydro-6h-purine-6-thione monohydrate,purine-6-thiol, monohydrate,unii-e7wed276i5 |
| IUPAC Name | 3,7-dihydropurine-6-thione;hydrate |
| InChI Key | WFFQYWAAEWLHJC-UHFFFAOYSA-N |
| Molecular Formula | C5H6N4OS |
Adenine Sulfate Dihydrate, >97%
CAS: 321-30-2 Molecular Formula: C10H12N10O4S Molecular Weight (g/mol): 368.33 MDL Number: MFCD00213655 InChI Key: LQXHSCOPYJCOMD-UHFFFAOYSA-N Synonym: adenine sulfate,adenine hemisulfate,7 h-purin-6-amine sulfate 2:1,adeninsulfat,adeninium sulfate,adenine sulfate 2:1,adeninsulfat german,1h-purin-6-amine, sulfate 2:1,diadenine sulphate,unii-741gjf3k9m PubChem CID: 9449 IUPAC Name: 7 H-purin-6-amine;sulfuric acid SMILES: OS(O)(=O)=O.NC1=C2NC=NC2=NC=N1.NC1=C2NC=NC2=NC=N1
| PubChem CID | 9449 |
|---|---|
| CAS | 321-30-2 |
| Molecular Weight (g/mol) | 368.33 |
| MDL Number | MFCD00213655 |
| SMILES | OS(O)(=O)=O.NC1=C2NC=NC2=NC=N1.NC1=C2NC=NC2=NC=N1 |
| Synonym | adenine sulfate,adenine hemisulfate,7 h-purin-6-amine sulfate 2:1,adeninsulfat,adeninium sulfate,adenine sulfate 2:1,adeninsulfat german,1h-purin-6-amine, sulfate 2:1,diadenine sulphate,unii-741gjf3k9m |
| IUPAC Name | 7 H-purin-6-amine;sulfuric acid |
| InChI Key | LQXHSCOPYJCOMD-UHFFFAOYSA-N |
| Molecular Formula | C10H12N10O4S |
Thermo Scientific Chemicals Omeprazole, 98+%
CAS: 73590-58-6 Molecular Formula: C17H19N3O3S Molecular Weight (g/mol): 345.42 InChI Key: SUBDBMMJDZJVOS-UHFFFAOYSA-N Synonym: omeprazole,losec,prilosec,antra,esomeprazole,omeprazon,audazol,omapren,omepral,parizac PubChem CID: 4594 ChEBI: CHEBI:77260 IUPAC Name: 6-methoxy-2-[(4-methoxy-3,5-dimethylpyridin-2-yl)methylsulfinyl]-1H-benzimidazole SMILES: CC1=CN=C(C(=C1OC)C)CS(=O)C2=NC3=C(N2)C=C(C=C3)OC
| PubChem CID | 4594 |
|---|---|
| CAS | 73590-58-6 |
| Molecular Weight (g/mol) | 345.42 |
| ChEBI | CHEBI:77260 |
| SMILES | CC1=CN=C(C(=C1OC)C)CS(=O)C2=NC3=C(N2)C=C(C=C3)OC |
| Synonym | omeprazole,losec,prilosec,antra,esomeprazole,omeprazon,audazol,omapren,omepral,parizac |
| IUPAC Name | 6-methoxy-2-[(4-methoxy-3,5-dimethylpyridin-2-yl)methylsulfinyl]-1H-benzimidazole |
| InChI Key | SUBDBMMJDZJVOS-UHFFFAOYSA-N |
| Molecular Formula | C17H19N3O3S |
Nicotinic acid, specified according to the requirements of Ph. Eur, Thermo Scientific Chemicals
CAS: 59-67-6 Molecular Formula: C6H5NO2 Molecular Weight (g/mol): 123.11 MDL Number: MFCD00006391 InChI Key: PVNIIMVLHYAWGP-UHFFFAOYSA-N Synonym: nicotinic acid,niacin,3-pyridinecarboxylic acid,3-carboxypyridine,wampocap,acidum nicotinicum,apelagrin,pellagrin,akotin,daskil PubChem CID: 938 ChEBI: CHEBI:15940 IUPAC Name: pyridine-3-carboxylic acid SMILES: OC(=O)C1=CC=CN=C1
| PubChem CID | 938 |
|---|---|
| CAS | 59-67-6 |
| Molecular Weight (g/mol) | 123.11 |
| ChEBI | CHEBI:15940 |
| MDL Number | MFCD00006391 |
| SMILES | OC(=O)C1=CC=CN=C1 |
| Synonym | nicotinic acid,niacin,3-pyridinecarboxylic acid,3-carboxypyridine,wampocap,acidum nicotinicum,apelagrin,pellagrin,akotin,daskil |
| IUPAC Name | pyridine-3-carboxylic acid |
| InChI Key | PVNIIMVLHYAWGP-UHFFFAOYSA-N |
| Molecular Formula | C6H5NO2 |
Purine, 99%
CAS: 120-73-0 MDL Number: MFCD00079221 InChI Key: KDCGOANMDULRCW-UHFFFAOYSA-N Synonym: purine,9h-purine,1h-purine,isopurine,beta-purine,7h-imidazo 4,5-d pyrimidine,imidazo 4,5-d pyrimidine,3,5,7-triazaindole,9h-purine van,3h-purine PubChem CID: 1044 ChEBI: CHEBI:17258 IUPAC Name: 7H-purine SMILES: C1=C2C(=NC=N1)N=CN2
| PubChem CID | 1044 |
|---|---|
| CAS | 120-73-0 |
| ChEBI | CHEBI:17258 |
| MDL Number | MFCD00079221 |
| SMILES | C1=C2C(=NC=N1)N=CN2 |
| Synonym | purine,9h-purine,1h-purine,isopurine,beta-purine,7h-imidazo 4,5-d pyrimidine,imidazo 4,5-d pyrimidine,3,5,7-triazaindole,9h-purine van,3h-purine |
| IUPAC Name | 7H-purine |
| InChI Key | KDCGOANMDULRCW-UHFFFAOYSA-N |
Methyl nicotinate, 99%
CAS: 93-60-7 Molecular Formula: C7H7NO2 Molecular Weight (g/mol): 137.14 MDL Number: MFCD00006388 InChI Key: YNBADRVTZLEFNH-UHFFFAOYSA-N Synonym: methyl nicotinate,nikomet,methylnicotinate,nicotinic acid methyl ester,nicometh,methyl 3-pyridinecarboxylate,methyl-nicotinate,3-pyridinecarboxylic acid, methyl ester,heat spray,nicotinic acid, methyl ester PubChem CID: 7151 IUPAC Name: methyl pyridine-3-carboxylate SMILES: COC(=O)C1=CN=CC=C1
| PubChem CID | 7151 |
|---|---|
| CAS | 93-60-7 |
| Molecular Weight (g/mol) | 137.14 |
| MDL Number | MFCD00006388 |
| SMILES | COC(=O)C1=CN=CC=C1 |
| Synonym | methyl nicotinate,nikomet,methylnicotinate,nicotinic acid methyl ester,nicometh,methyl 3-pyridinecarboxylate,methyl-nicotinate,3-pyridinecarboxylic acid, methyl ester,heat spray,nicotinic acid, methyl ester |
| IUPAC Name | methyl pyridine-3-carboxylate |
| InChI Key | YNBADRVTZLEFNH-UHFFFAOYSA-N |
| Molecular Formula | C7H7NO2 |
N-(Benzyloxycarbonyloxy)succinimide, 98%
CAS: 13139-17-8 Molecular Formula: C12H11NO5 Molecular Weight (g/mol): 249.222 MDL Number: MFCD00005513 InChI Key: MJSHDCCLFGOEIK-UHFFFAOYSA-N Synonym: n-benzyloxycarbonyloxy succinimide,cbz-osu,cbz-onsu,benzyl 2,5-dioxopyrrolidin-1-yl carbonate,benzyl succinimido carbonate,z-osu,n-carbobenzoxyoxysuccinimide,n-benzyloxycarbonyloxy-succinimide,cbzosu,carbobenzoxy succinimide PubChem CID: 83172 IUPAC Name: benzyl (2,5-dioxopyrrolidin-1-yl) carbonate SMILES: C1CC(=O)N(C1=O)OC(=O)OCC2=CC=CC=C2
| PubChem CID | 83172 |
|---|---|
| CAS | 13139-17-8 |
| Molecular Weight (g/mol) | 249.222 |
| MDL Number | MFCD00005513 |
| SMILES | C1CC(=O)N(C1=O)OC(=O)OCC2=CC=CC=C2 |
| Synonym | n-benzyloxycarbonyloxy succinimide,cbz-osu,cbz-onsu,benzyl 2,5-dioxopyrrolidin-1-yl carbonate,benzyl succinimido carbonate,z-osu,n-carbobenzoxyoxysuccinimide,n-benzyloxycarbonyloxy-succinimide,cbzosu,carbobenzoxy succinimide |
| IUPAC Name | benzyl (2,5-dioxopyrrolidin-1-yl) carbonate |
| InChI Key | MJSHDCCLFGOEIK-UHFFFAOYSA-N |
| Molecular Formula | C12H11NO5 |
3-Ethylpyridine, 98%
CAS: 536-78-7 Molecular Formula: C7H9N Molecular Weight (g/mol): 107.156 MDL Number: MFCD00006413 InChI Key: MFEIKQPHQINPRI-UHFFFAOYSA-N Synonym: pyridine, 3-ethyl,3-ethyl pyridine,beta-lutidine,beta-ethylpyridine,3-ethyl-pyridine,5-ethylpyridine,unii-a25i3ez88v,lutidine, beta,3ethylpyridine,fema no. 3394 PubChem CID: 10823 IUPAC Name: 3-ethylpyridine SMILES: CCC1=CN=CC=C1
| PubChem CID | 10823 |
|---|---|
| CAS | 536-78-7 |
| Molecular Weight (g/mol) | 107.156 |
| MDL Number | MFCD00006413 |
| SMILES | CCC1=CN=CC=C1 |
| Synonym | pyridine, 3-ethyl,3-ethyl pyridine,beta-lutidine,beta-ethylpyridine,3-ethyl-pyridine,5-ethylpyridine,unii-a25i3ez88v,lutidine, beta,3ethylpyridine,fema no. 3394 |
| IUPAC Name | 3-ethylpyridine |
| InChI Key | MFEIKQPHQINPRI-UHFFFAOYSA-N |
| Molecular Formula | C7H9N |