Organoheterocyclic compounds
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Thiocyanuric Acid 98.0+%, TCI America™
CAS: 638-16-4 Molecular Formula: C3H3N3S3 Molecular Weight (g/mol): 177.258 MDL Number: MFCD00006052 InChI Key: WZRRRFSJFQTGGB-UHFFFAOYSA-N Synonym: trithiocyanuric acid,thiocyanuric acid,1,3,5-triazine-2,4,6-trithiol,trismercaptotriazine,trimercaptocyanuric acid,cyanuric acid, trithio,usaf th-3,1,3,5-triazine-2,4,6 1h,3h,5h-trithione,s-triazine-2,4,6-trithiol,2,4,6-triazinetrithiol PubChem CID: 1268121 IUPAC Name: 1,3,5-triazinane-2,4,6-trithione SMILES: C1(=S)NC(=S)NC(=S)N1
| PubChem CID | 1268121 |
|---|---|
| CAS | 638-16-4 |
| Molecular Weight (g/mol) | 177.258 |
| MDL Number | MFCD00006052 |
| SMILES | C1(=S)NC(=S)NC(=S)N1 |
| Synonym | trithiocyanuric acid,thiocyanuric acid,1,3,5-triazine-2,4,6-trithiol,trismercaptotriazine,trimercaptocyanuric acid,cyanuric acid, trithio,usaf th-3,1,3,5-triazine-2,4,6 1h,3h,5h-trithione,s-triazine-2,4,6-trithiol,2,4,6-triazinetrithiol |
| IUPAC Name | 1,3,5-triazinane-2,4,6-trithione |
| InChI Key | WZRRRFSJFQTGGB-UHFFFAOYSA-N |
| Molecular Formula | C3H3N3S3 |
(S)-Glycidyl Phenyl Ether 98.0+%, TCI America™
CAS: 71031-03-3 Molecular Formula: C9H10O2 Molecular Weight (g/mol): 150.177 MDL Number: MFCD06659026 InChI Key: FQYUMYWMJTYZTK-SECBINFHSA-N Synonym: (S)-2-(Phenoxymethyl)oxirane, (S)-1,2-Epoxy-3-phenoxypropane PubChem CID: 1534345 IUPAC Name: (2S)-2-(phenoxymethyl)oxirane SMILES: C1C(O1)COC2=CC=CC=C2
| PubChem CID | 1534345 |
|---|---|
| CAS | 71031-03-3 |
| Molecular Weight (g/mol) | 150.177 |
| MDL Number | MFCD06659026 |
| SMILES | C1C(O1)COC2=CC=CC=C2 |
| Synonym | (S)-2-(Phenoxymethyl)oxirane, (S)-1,2-Epoxy-3-phenoxypropane |
| IUPAC Name | (2S)-2-(phenoxymethyl)oxirane |
| InChI Key | FQYUMYWMJTYZTK-SECBINFHSA-N |
| Molecular Formula | C9H10O2 |
Mizolastine 98.0+%, TCI America™
CAS: 108612-45-9 Molecular Formula: C24H25FN6O Molecular Weight (g/mol): 432.50 MDL Number: MFCD00864625 InChI Key: PVLJETXTTWAYEW-UHFFFAOYSA-N PubChem CID: 65906 IUPAC Name: 2-[(1-{1-[(4-fluorophenyl)methyl]-1H-1,3-benzodiazol-2-yl}piperidin-4-yl)(methyl)amino]-3,4-dihydropyrimidin-4-one SMILES: CN(C1CCN(CC1)C1=NC2=CC=CC=C2N1CC1=CC=C(F)C=C1)C1=NC=CC(=O)N1
| PubChem CID | 65906 |
|---|---|
| CAS | 108612-45-9 |
| Molecular Weight (g/mol) | 432.50 |
| MDL Number | MFCD00864625 |
| SMILES | CN(C1CCN(CC1)C1=NC2=CC=CC=C2N1CC1=CC=C(F)C=C1)C1=NC=CC(=O)N1 |
| IUPAC Name | 2-[(1-{1-[(4-fluorophenyl)methyl]-1H-1,3-benzodiazol-2-yl}piperidin-4-yl)(methyl)amino]-3,4-dihydropyrimidin-4-one |
| InChI Key | PVLJETXTTWAYEW-UHFFFAOYSA-N |
| Molecular Formula | C24H25FN6O |
2-Chloropyridine 98.0+%, TCI America™
CAS: 109-09-1 Molecular Formula: C5H4ClN Molecular Weight (g/mol): 113.544 MDL Number: MFCD00006228 InChI Key: OKDGRDCXVWSXDC-UHFFFAOYSA-N Synonym: o-chloropyridine,pyridine, 2-chloro,alpha-chloropyridine,.alpha.-chloropyridine,unii-8hmd45ayej,2-chloro-pyridine,ccris 1724,8hmd45ayej,6-chloro-pyridine,dsstox_cid_4810 PubChem CID: 7977 ChEBI: CHEBI:39174 IUPAC Name: 2-chloropyridine SMILES: C1=CC=NC(=C1)Cl
| PubChem CID | 7977 |
|---|---|
| CAS | 109-09-1 |
| Molecular Weight (g/mol) | 113.544 |
| ChEBI | CHEBI:39174 |
| MDL Number | MFCD00006228 |
| SMILES | C1=CC=NC(=C1)Cl |
| Synonym | o-chloropyridine,pyridine, 2-chloro,alpha-chloropyridine,.alpha.-chloropyridine,unii-8hmd45ayej,2-chloro-pyridine,ccris 1724,8hmd45ayej,6-chloro-pyridine,dsstox_cid_4810 |
| IUPAC Name | 2-chloropyridine |
| InChI Key | OKDGRDCXVWSXDC-UHFFFAOYSA-N |
| Molecular Formula | C5H4ClN |
1-(tert-Butoxycarbonyl)piperazine 98.0+%, TCI America™
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: 4-[(tert-butoxy)carbonyl]piperazin-1-ium 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 | 4-[(tert-butoxy)carbonyl]piperazin-1-ium |
| InChI Key | CWXPZXBSDSIRCS-UHFFFAOYSA-O |
| Molecular Formula | C9H19N2O2 |
2-Ethyl-4-methylimidazole 95.0+%, TCI America™
CAS: 931-36-2 Molecular Formula: C6H10N2 Molecular Weight (g/mol): 110.16 MDL Number: MFCD00005193 InChI Key: ULKLGIFJWFIQFF-UHFFFAOYSA-N Synonym: 2-ethyl-4-methylimidazole,2-ethyl-4-methyl-1h-imidazole,1h-imidazole, 2-ethyl-4-methyl,4-methyl-2-ethylimidazole,1h-imidazole, 2-ethyl-5-methyl,imidazole, 2-ethyl-4-methyl,unii-5k8xi641g3,2-ethyl-4-methyl-imidazole,2-ethyl-4-methyl-3h-imidazole,curazol 2e4mz PubChem CID: 70262 IUPAC Name: 2-ethyl-5-methyl-1H-imidazole SMILES: CCC1=NC=C(N1)C
| PubChem CID | 70262 |
|---|---|
| CAS | 931-36-2 |
| Molecular Weight (g/mol) | 110.16 |
| MDL Number | MFCD00005193 |
| SMILES | CCC1=NC=C(N1)C |
| Synonym | 2-ethyl-4-methylimidazole,2-ethyl-4-methyl-1h-imidazole,1h-imidazole, 2-ethyl-4-methyl,4-methyl-2-ethylimidazole,1h-imidazole, 2-ethyl-5-methyl,imidazole, 2-ethyl-4-methyl,unii-5k8xi641g3,2-ethyl-4-methyl-imidazole,2-ethyl-4-methyl-3h-imidazole,curazol 2e4mz |
| IUPAC Name | 2-ethyl-5-methyl-1H-imidazole |
| InChI Key | ULKLGIFJWFIQFF-UHFFFAOYSA-N |
| Molecular Formula | C6H10N2 |
2,2'-Bipyrimidyl 95.0+%, TCI America™
CAS: 34671-83-5 Molecular Formula: C8H6N4 Molecular Weight (g/mol): 158.16 MDL Number: MFCD00014600 InChI Key: HKOAFLAGUQUJQG-UHFFFAOYSA-N Synonym: 2,2'-bipyrimidine,2,2'-bipyrimidyl,2,2-bipyrimidine,bpym,2-pyrimidin-2-yl pyrimidine,bipyrimidine,2,2'-bipyrimidinyl,2,2'-dipyrimidyl,2,2;-bipyrimidine PubChem CID: 123444 IUPAC Name: 2,2'-bipyrimidine SMILES: C1=CN=C(N=C1)C1=NC=CC=N1
| PubChem CID | 123444 |
|---|---|
| CAS | 34671-83-5 |
| Molecular Weight (g/mol) | 158.16 |
| MDL Number | MFCD00014600 |
| SMILES | C1=CN=C(N=C1)C1=NC=CC=N1 |
| Synonym | 2,2'-bipyrimidine,2,2'-bipyrimidyl,2,2-bipyrimidine,bpym,2-pyrimidin-2-yl pyrimidine,bipyrimidine,2,2'-bipyrimidinyl,2,2'-dipyrimidyl,2,2;-bipyrimidine |
| IUPAC Name | 2,2'-bipyrimidine |
| InChI Key | HKOAFLAGUQUJQG-UHFFFAOYSA-N |
| Molecular Formula | C8H6N4 |
Dihydroartemisinin 98.0+%, TCI America™
CAS: 71939-50-9 Molecular Formula: C15H24O5 Molecular Weight (g/mol): 284.35 MDL Number: MFCD00236467,MFCD00274495,MFCD00274495,MFCD28384156 InChI Key: BJDCWCLMFKKGEE-KXTPALSWSA-N PubChem CID: 44264589 IUPAC Name: (4S,5R,8S,9R,10S,12R,13R)-1,5,9-trimethyl-11,14,15,16-tetraoxatetracyclo[10.3.1.0⁴,¹³.0⁸,¹³]hexadecan-10-ol SMILES: C[C@@H]1CC[C@H]2[C@@H](C)[C@@H](O)O[C@@H]3OC4(C)CC[C@@H]1[C@@]23OO4
| PubChem CID | 44264589 |
|---|---|
| CAS | 71939-50-9 |
| Molecular Weight (g/mol) | 284.35 |
| MDL Number | MFCD00236467,MFCD00274495,MFCD00274495,MFCD28384156 |
| SMILES | C[C@@H]1CC[C@H]2[C@@H](C)[C@@H](O)O[C@@H]3OC4(C)CC[C@@H]1[C@@]23OO4 |
| IUPAC Name | (4S,5R,8S,9R,10S,12R,13R)-1,5,9-trimethyl-11,14,15,16-tetraoxatetracyclo[10.3.1.0⁴,¹³.0⁸,¹³]hexadecan-10-ol |
| InChI Key | BJDCWCLMFKKGEE-KXTPALSWSA-N |
| Molecular Formula | C15H24O5 |
1-(2-Hydroxyethyl)piperazine 99.0+%, TCI America™
CAS: 103-76-4 Molecular Formula: C6H14N2O Molecular Weight (g/mol): 130.191 MDL Number: MFCD00005970 InChI Key: WFCSWCVEJLETKA-UHFFFAOYSA-N Synonym: n-2-hydroxyethyl piperazine,1-piperazineethanol,1-2-hydroxyethyl piperazine,hydroxyethylpiperazine,2-1-piperazinyl ethanol,2-hydroxyethylpiperazine,2-piperazinoethanol,2-piperazin-1-yl ethan-1-ol,1-piperazinethanol,4-2-hydroxyethyl piperazine PubChem CID: 7677 IUPAC Name: 2-piperazin-1-ylethanol SMILES: C1CN(CCN1)CCO
| PubChem CID | 7677 |
|---|---|
| CAS | 103-76-4 |
| Molecular Weight (g/mol) | 130.191 |
| MDL Number | MFCD00005970 |
| SMILES | C1CN(CCN1)CCO |
| Synonym | n-2-hydroxyethyl piperazine,1-piperazineethanol,1-2-hydroxyethyl piperazine,hydroxyethylpiperazine,2-1-piperazinyl ethanol,2-hydroxyethylpiperazine,2-piperazinoethanol,2-piperazin-1-yl ethan-1-ol,1-piperazinethanol,4-2-hydroxyethyl piperazine |
| IUPAC Name | 2-piperazin-1-ylethanol |
| InChI Key | WFCSWCVEJLETKA-UHFFFAOYSA-N |
| Molecular Formula | C6H14N2O |
Gramine 98.0+%, TCI America™
CAS: 87-52-5 Molecular Formula: C11H14N2 Molecular Weight (g/mol): 174.247 MDL Number: MFCD00005629 InChI Key: OCDGBSUVYYVKQZ-UHFFFAOYSA-N Synonym: gramine,3-dimethylaminomethyl indole,donaxine,donaxin,gramin,1h-indole-3-methanamine, n,n-dimethyl,beta-dimethylaminomethylindole,1-1h-indol-3-yl-n,n-dimethylmethanamine,indol-3-ylmethyldimethylamine,1h-indol-3-ylmethyl dimethylamine PubChem CID: 6890 ChEBI: CHEBI:28948 IUPAC Name: 1-(1H-indol-3-yl)-N,N-dimethylmethanamine SMILES: CN(C)CC1=CNC2=CC=CC=C21
| PubChem CID | 6890 |
|---|---|
| CAS | 87-52-5 |
| Molecular Weight (g/mol) | 174.247 |
| ChEBI | CHEBI:28948 |
| MDL Number | MFCD00005629 |
| SMILES | CN(C)CC1=CNC2=CC=CC=C21 |
| Synonym | gramine,3-dimethylaminomethyl indole,donaxine,donaxin,gramin,1h-indole-3-methanamine, n,n-dimethyl,beta-dimethylaminomethylindole,1-1h-indol-3-yl-n,n-dimethylmethanamine,indol-3-ylmethyldimethylamine,1h-indol-3-ylmethyl dimethylamine |
| IUPAC Name | 1-(1H-indol-3-yl)-N,N-dimethylmethanamine |
| InChI Key | OCDGBSUVYYVKQZ-UHFFFAOYSA-N |
| Molecular Formula | C11H14N2 |
Adenine 99.0+%, TCI America™
CAS: 73-24-5 Molecular Formula: C5H5N5 Molecular Weight (g/mol): 135.13 MDL Number: MFCD00041790 InChI Key: GFFGJBXGBJISGV-UHFFFAOYSA-N Synonym: adenine,1h-purin-6-amine,6-aminopurine,9h-purin-6-amine,vitamin b4,adenin,adeninimine,leuco-4,6-amino-1h-purine,6-amino-3h-purine PubChem CID: 190 ChEBI: CHEBI:16708 IUPAC Name: 7H-purin-6-amine SMILES: NC1=C2NC=NC2=NC=N1
| PubChem CID | 190 |
|---|---|
| CAS | 73-24-5 |
| Molecular Weight (g/mol) | 135.13 |
| ChEBI | CHEBI:16708 |
| MDL Number | MFCD00041790 |
| SMILES | NC1=C2NC=NC2=NC=N1 |
| Synonym | adenine,1h-purin-6-amine,6-aminopurine,9h-purin-6-amine,vitamin b4,adenin,adeninimine,leuco-4,6-amino-1h-purine,6-amino-3h-purine |
| IUPAC Name | 7H-purin-6-amine |
| InChI Key | GFFGJBXGBJISGV-UHFFFAOYSA-N |
| Molecular Formula | C5H5N5 |
1-Phenylimidazole 98.0+%, TCI America™
CAS: 7164-98-9 Molecular Formula: C9H8N2 Molecular Weight (g/mol): 144.18 MDL Number: MFCD00041204 InChI Key: SEULWJSKCVACTH-UHFFFAOYSA-N Synonym: 1-phenyl-1h-imidazole,phenylimidazole,n-phenylimidazole,1h-imidazole, 1-phenyl,1h-imidazole, phenyl,n-phenyl imidazole,pubchem12611,acmc-20aos8,1-phenylimidazole,1-phenyl-1h-imidazole # PubChem CID: 81595 IUPAC Name: 1-phenyl-1H-imidazole SMILES: C1=CN(C=N1)C1=CC=CC=C1
| PubChem CID | 81595 |
|---|---|
| CAS | 7164-98-9 |
| Molecular Weight (g/mol) | 144.18 |
| MDL Number | MFCD00041204 |
| SMILES | C1=CN(C=N1)C1=CC=CC=C1 |
| Synonym | 1-phenyl-1h-imidazole,phenylimidazole,n-phenylimidazole,1h-imidazole, 1-phenyl,1h-imidazole, phenyl,n-phenyl imidazole,pubchem12611,acmc-20aos8,1-phenylimidazole,1-phenyl-1h-imidazole # |
| IUPAC Name | 1-phenyl-1H-imidazole |
| InChI Key | SEULWJSKCVACTH-UHFFFAOYSA-N |
| Molecular Formula | C9H8N2 |
Pyridoxine Hydrochloride 98.0+%, TCI America™
CAS: 58-56-0 Molecular Formula: C8H12ClNO3 Molecular Weight (g/mol): 205.638 MDL Number: MFCD00012807 InChI Key: ZUFQODAHGAHPFQ-UHFFFAOYSA-N Synonym: pyridoxine hydrochloride,pyridoxine hcl,pyridoxol hydrochloride,vitamin b6,alestrol,becilan,benadon,hexavibex,hexermin,hexobion PubChem CID: 6019 ChEBI: CHEBI:30961 IUPAC Name: 4,5-bis(hydroxymethyl)-2-methylpyridin-3-ol;hydrochloride SMILES: CC1=NC=C(C(=C1O)CO)CO.Cl
| PubChem CID | 6019 |
|---|---|
| CAS | 58-56-0 |
| Molecular Weight (g/mol) | 205.638 |
| ChEBI | CHEBI:30961 |
| MDL Number | MFCD00012807 |
| SMILES | CC1=NC=C(C(=C1O)CO)CO.Cl |
| Synonym | pyridoxine hydrochloride,pyridoxine hcl,pyridoxol hydrochloride,vitamin b6,alestrol,becilan,benadon,hexavibex,hexermin,hexobion |
| IUPAC Name | 4,5-bis(hydroxymethyl)-2-methylpyridin-3-ol;hydrochloride |
| InChI Key | ZUFQODAHGAHPFQ-UHFFFAOYSA-N |
| Molecular Formula | C8H12ClNO3 |
Dimethyl 4-Chloro-2,6-pyridinedicarboxylate 98.0+%, TCI America™
CAS: 5371-70-0 Molecular Formula: C9H8ClNO4 Molecular Weight (g/mol): 229.616 MDL Number: MFCD02612781 InChI Key: NFXKYKHKNUFOKB-UHFFFAOYSA-N Synonym: dimethyl 4-chloro-2,6-pyridinedicarboxylate,methyl 4-chloropyridine-2,6-dicarboxylate,2,6-dimethyl 4-chloropyridine-2,6-dicarboxylate,2,6-pyridinedicarboxylic acid, 4-chloro-, dimethyl ester,4-chloropyridine-2,6-dicarboxylic acid,dimethyl ester,methyl 4-chloro-6-methoxycarbonyl pyridine-2-carboxylate,4-chloro-2,6-pyridinedicarboxylic acid dimethyl ester,pubchem20951,pych37,ksc496e3d PubChem CID: 237845 IUPAC Name: dimethyl 4-chloropyridine-2,6-dicarboxylate SMILES: COC(=O)C1=CC(=CC(=N1)C(=O)OC)Cl
| PubChem CID | 237845 |
|---|---|
| CAS | 5371-70-0 |
| Molecular Weight (g/mol) | 229.616 |
| MDL Number | MFCD02612781 |
| SMILES | COC(=O)C1=CC(=CC(=N1)C(=O)OC)Cl |
| Synonym | dimethyl 4-chloro-2,6-pyridinedicarboxylate,methyl 4-chloropyridine-2,6-dicarboxylate,2,6-dimethyl 4-chloropyridine-2,6-dicarboxylate,2,6-pyridinedicarboxylic acid, 4-chloro-, dimethyl ester,4-chloropyridine-2,6-dicarboxylic acid,dimethyl ester,methyl 4-chloro-6-methoxycarbonyl pyridine-2-carboxylate,4-chloro-2,6-pyridinedicarboxylic acid dimethyl ester,pubchem20951,pych37,ksc496e3d |
| IUPAC Name | dimethyl 4-chloropyridine-2,6-dicarboxylate |
| InChI Key | NFXKYKHKNUFOKB-UHFFFAOYSA-N |
| Molecular Formula | C9H8ClNO4 |
1,2-Di(4-pyridyl)ethylene 98.0+%, TCI America™
CAS: 13362-78-2 Molecular Formula: C12H10N2 Molecular Weight (g/mol): 182.226 MDL Number: MFCD00006448 InChI Key: MGFJDEHFNMWYBD-OWOJBTEDSA-N Synonym: 4,4'-vinylenedipyridine,1,2-di 4-pyridyl ethylene,1,2-bis 4-pyridyl ethylene,1,2-di pyridin-4-yl ethene,trans-1,2-bis 4-pyridyl ethylene,1,2-di-4-pyridylethene,e-1,2-di pyridin-4-yl ethene,pyridine, 4,4'-1e-1,2-ethenediylbis,4-4-pyridylvinyl pyridine,pyridine, 4,4'-1,2-ethenediyl bis-, e PubChem CID: 776222 IUPAC Name: 4-[(E)-2-pyridin-4-ylethenyl]pyridine SMILES: C1=CN=CC=C1C=CC2=CC=NC=C2
| PubChem CID | 776222 |
|---|---|
| CAS | 13362-78-2 |
| Molecular Weight (g/mol) | 182.226 |
| MDL Number | MFCD00006448 |
| SMILES | C1=CN=CC=C1C=CC2=CC=NC=C2 |
| Synonym | 4,4'-vinylenedipyridine,1,2-di 4-pyridyl ethylene,1,2-bis 4-pyridyl ethylene,1,2-di pyridin-4-yl ethene,trans-1,2-bis 4-pyridyl ethylene,1,2-di-4-pyridylethene,e-1,2-di pyridin-4-yl ethene,pyridine, 4,4'-1e-1,2-ethenediylbis,4-4-pyridylvinyl pyridine,pyridine, 4,4'-1,2-ethenediyl bis-, e |
| IUPAC Name | 4-[(E)-2-pyridin-4-ylethenyl]pyridine |
| InChI Key | MGFJDEHFNMWYBD-OWOJBTEDSA-N |
| Molecular Formula | C12H10N2 |