Organoheterocyclic compounds
3-(4,5-Dimethylthiazolyl-2)-2,5-Diphenyl Tetrazolium Bromide, MP Biomedicals™
CAS: 298-93-1 Molecular Formula: C18H16BrN5S Molecular Weight (g/mol): 414.33 MDL Number: MFCD00011964,MFCD00066662 InChI Key: AZKSAVLVSZKNRD-UHFFFAOYSA-M Synonym: thiazolyl blue,thiazolyl blue tetrazolium bromide,mmt tetrazolium,methylthiazoletetrazolium,mtt,thiazolyl blue monotetrazolium,thiazole blue,3-4,5-dimethylthiazol-2-yl-2,5-diphenyltetrazolium bromide,mtt van,unii-euy85h477i PubChem CID: 64965 ChEBI: CHEBI:53233 IUPAC Name: 2-(4,5-dimethyl-1,3-thiazol-2-yl)-3,5-diphenyl-3H-1,2λ⁵,3,4-tetrazol-2-ylium bromide SMILES: [Br-].CC1=C(C)N=C(S1)[N+]1=NC(=NN1C1=CC=CC=C1)C1=CC=CC=C1
D-Biotin, MP Biomedicals™
CAS: 58-85-5 Molecular Formula: C10H16N2O3S Molecular Weight (g/mol): 244.31 MDL Number: MFCD00005541 InChI Key: YBJHBAHKTGYVGT-UHFFFAOYNA-N Synonym: biotin,d-biotin,vitamin h,coenzyme r,vitamin b7,bios ii,factor s,bioepiderm,d +-biotin,biodermatin PubChem CID: 171548 ChEBI: CHEBI:15956 IUPAC Name: 5-{2-oxo-hexahydro-1H-thieno[3,4-d]imidazol-4-yl}pentanoic acid SMILES: OC(=O)CCCCC1SCC2NC(=O)NC12
3-(4,5-Dimethylthiazolyl-2)-2,5-Diphenyl Tetrazolium Bromide, MP Biomedicals
CAS: 298-93-1 Molecular Formula: C18H16BrN5S Molecular Weight (g/mol): 414.33 MDL Number: MFCD00011964,MFCD00066662 InChI Key: AZKSAVLVSZKNRD-UHFFFAOYSA-M Synonym: thiazolyl blue,thiazolyl blue tetrazolium bromide,mmt tetrazolium,methylthiazoletetrazolium,mtt,thiazolyl blue monotetrazolium,thiazole blue,3-4,5-dimethylthiazol-2-yl-2,5-diphenyltetrazolium bromide,mtt van,unii-euy85h477i PubChem CID: 64965 ChEBI: CHEBI:53233 IUPAC Name: 2-(4,5-dimethyl-1,3-thiazol-2-yl)-3,5-diphenyl-3H-1,2λ⁵,3,4-tetrazol-2-ylium bromide SMILES: [Br-].CC1=C(C)N=C(S1)[N+]1=NC(=NN1C1=CC=CC=C1)C1=CC=CC=C1
Adenine Sulfate, MP Biomedicals
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,7h-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: bis(7H-purin-6-amine); sulfuric acid SMILES: OS(O)(=O)=O.NC1=C2NC=NC2=NC=N1.NC1=C2NC=NC2=NC=N1
Thermo Scientific Chemicals Itraconazole, 99%
CAS: 84625-61-6 Molecular Formula: C35H38Cl2N8O4 Molecular Weight (g/mol): 705.64 MDL Number: MFCD00870168,MFCD00941396 InChI Key: VHVPQPYKVGDNFY-ZPGVKDDISA-N Synonym: itraconazole-d5,itraconazole,oriconazole-d5,triasporin-d5,sporamelt-d5,itrizole-d5,sporanox-d5,+/--4-4-4-4-2r,4s-2,4-dichlorophenyl-2-1h-1,2,4-triazol-1-ylmethyl-1,3-dioxolan-4-yl methoxy phenyl-1-piperazinyl phenyl-2,4-dihydro-2-1-methylpropyl-d5-3h-1,2,4-triazol-3-one,2h5-4-4-4-4-2-1h-1,2,4-triazol-1-yl methyl-2-2,4-dichlorophenyl-1,3-dioxolan-4-yl methoxy phenyl piperazin-1-yl phenyl-1-sec-butyl-1h-1,2,4-triazol-5 4h-one,2-3,3,4,4,4-2 h? butan-2-yl-4-4-4-4-2r,4s-2-2,4-dichlorophenyl-2-1,2,4-triazol-1-ylmethyl-1,3-dioxolan-4-yl methoxy phenyl piperazin-1-yl phenyl-1,2,4-triazol-3-one PubChem CID: 45039617 IUPAC Name: 4-[4-[4-[4-[[(2R,4S)-2-(2,4-dichlorophenyl)-2-(1,2,4-triazol-1-ylmethyl)-1,3-dioxolan-4-yl]methoxy]phenyl]piperazin-1-yl]phenyl]-2-(3,3,4,4,4-pentadeuteriobutan-2-yl)-1,2,4-triazol-3-one SMILES: CCC(C)N1N=CN(C1=O)C1=CC=C(C=C1)N1CCN(CC1)C1=CC=C(OC[C@H]2CO[C@@](CN3C=NC=N3)(O2)C2=CC=C(Cl)C=C2Cl)C=C1
Topiramate, 98%
CAS: 97240-79-4 Molecular Formula: C12H21NO8S Molecular Weight (g/mol): 339.36 InChI Key: KJADKKWYZYXHBB-XBWDGYHZSA-N Synonym: topiramate,topamax,epitomax,topamax sprinkle,tipiramate,topiramatum,tipiramato,topiramato,tipiramate french,tipiramato spanish PubChem CID: 5284627 ChEBI: CHEBI:63631 IUPAC Name: [(3aS,5aR,8aR,8bS)-2,2,7,7-tetramethyl-5,5a,8a,8b-tetrahydrodi[1,3]dioxolo[4,5-a SMILES: CC1(OC2COC3(C(C2O1)OC(O3)(C)C)COS(=O)(=O)N)C
2,4-Dihydroxypyrimidine-5-carboxylic acid, 98%
CAS: 23945-44-0 Molecular Formula: C5H4N2O4 Molecular Weight (g/mol): 156.1 MDL Number: MFCD00149397 InChI Key: ZXYAAVBXHKCJJB-UHFFFAOYSA-N Synonym: 2,4-dihydroxypyrimidine-5-carboxylic acid,uracil 5-carboxylic acid,isoorotic acid,uracil-5-carboxylic acid,5-carboxyuracil,2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylic acid,2,4-dihydroxy-5-pyrimidinecarboxylic acid,5-uracilcarboxylic acid,5-pyrimidinecarboxylic acid, 1,2,3,4-tetrahydro-2,4-dioxo,uracil 5-carboxylate PubChem CID: 90301 ChEBI: CHEBI:17477 IUPAC Name: 2,4-dioxo-1H-pyrimidine-5-carboxylic acid SMILES: C1=C(C(=O)NC(=O)N1)C(=O)O
Lamotrigine, 98%
CAS: 84057-84-1 Molecular Formula: C9H7Cl2N5 Molecular Weight (g/mol): 256.09 MDL Number: MFCD00865333 InChI Key: PYZRQGJRPPTADH-UHFFFAOYSA-N Synonym: lamotrigine,6-2,3-dichlorophenyl-1,2,4-triazine-3,5-diamine,lamictal,lamictal cd,lamotrigina,lamotriginum,lamictal xr,lamotriginum latin,lamotrigina spanish,lamictal odt PubChem CID: 3878 ChEBI: CHEBI:6367 IUPAC Name: 6-(2,3-dichlorophenyl)-1,2,4-triazine-3,5-diamine SMILES: NC1=NN=C(C(N)=N1)C1=CC=CC(Cl)=C1Cl
4-Phenyl-4-piperidinecarboxylic acid p-methylbenzenesulfonate, 98%
CAS: 83949-32-0 Molecular Formula: C12H15NO2·C7H8O3S Molecular Weight (g/mol): 377.45 MDL Number: MFCD00044709 InChI Key: NQLZTDKDXBKUGY-UHFFFAOYSA-N Synonym: 4-methylbenzene-1-sulfonic acid; 4-phenylpiperidine-4-carboxylic acid,4-carboxy-4-phenylpiperidine tosylate,4-phenylpiperidine-4-carboxylic acid compound with 4-methylbenzenesulfonic acid 1:1,4-phenyl-4-piperidinecarboxylic acid p-methylbenzenesulfonate,4-phenyl-4-piperidinecarboxylic acid 4-methylbenzenesulfonate,4-phenylpiperidine-4-carboxylic acid 4-toluenesulfonate,isonipecotic acid, 4-phenyl-; para-toluene sulfonate,4-phenyl-4-carboxy piperidine tosylate,4-carboxy-4-phenylpiperidine p-toluenesulfonate,4-phenyl-piperidine-4-carboxylic acid tosylate PubChem CID: 2723657 IUPAC Name: 4-methylbenzenesulfonic acid;4-phenylpiperidine-4-carboxylic acid SMILES: CC1=CC=C(C=C1)S(=O)(=O)O.C1CNCCC1(C2=CC=CC=C2)C(=O)O
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
2-Thiohydantoin, 98%
CAS: 503-87-7 Molecular Formula: C3H4N2OS Molecular Weight (g/mol): 116.14 MDL Number: MFCD00005277 InChI Key: UGWULZWUXSCWPX-UHFFFAOYSA-N Synonym: 2-thiohydantoin,thiohydantoin,4-imidazolidinone, 2-thioxo,2-thioxoimidazolidin-4-one,2-thioguidanthion,hydantoin, 2-thio,usaf be-25,2-thioxo-4-imidazolidinone,2-thioxo-1,3-diazolidin-4-one,glycine thiohydantoin PubChem CID: 1274030 IUPAC Name: 2-sulfanylideneimidazolidin-4-one SMILES: O=C1CNC(=S)N1
2-Bromo-6-(4-morpholinyl)benzonitrile, 98%, Thermo Scientific Chemicals
CAS: 1129540-65-3 Molecular Formula: C11H11BrN2O Molecular Weight (g/mol): 267.13 MDL Number: MFCD11037772 InChI Key: HKIGGSMIIBGCKZ-UHFFFAOYSA-N Synonym: 2-bromo-6-morpholinobenzonitrile,2-bromo-6-morpholin-4-yl benzonitrile PubChem CID: 59588248 SMILES: BrC1=CC=CC(N2CCOCC2)=C1C#N
3-Morpholinobenzoic acid, 97%, Thermo Scientific™
CAS: 215309-00-5 Molecular Formula: C11H13NO3 Molecular Weight (g/mol): 207.229 MDL Number: MFCD06659078 InChI Key: VSKFQESEPGOWBS-UHFFFAOYSA-N Synonym: 3-morpholinobenzoic acid,3-4-morpholinyl benzoic acid,3-morpholin-4-yl-benzoic acid,3-morpholin-4-yl benzoic acid,3-morpholinobenzoicacid,benzoic acid, 3-4-morpholinyl,4-3-carboxyphenyl morpholine,pubchem19534,3-4-morpholino benzoic acid PubChem CID: 2795549 IUPAC Name: 3-morpholin-4-ylbenzoic acid SMILES: C1COCCN1C2=CC=CC(=C2)C(=O)O
(4-Methyl-3,4-dihydro-2H-1,4-benzoxazin-7-yl)methylamine, 97%, Thermo Scientific™
CAS: 946409-08-1 Molecular Formula: C10H14N2O Molecular Weight (g/mol): 178.235 MDL Number: MFCD11109315 InChI Key: PGIOCCIKSFJJMR-UHFFFAOYSA-N Synonym: 4-methyl-3,4-dihydro-2h-1,4-benzoxazin-7-yl methylamine,4-methyl-2,3-dihydro-1,4-benzoxazin-7-yl methanamine,4-methyl-3,4-dihydro-2h-benzo b 1,4 oxazin-7-yl methanamine,1-4-methyl-2,3-dihydro-1,4-benzoxazin-7-yl methanamine,4-methyl-2h,3h-benzo e 1,4-oxazin-7-yl methylamine,1-4-methyl-3,4-dihydro-2h-1,4-benzoxazin-7-yl methanamine PubChem CID: 33589445 IUPAC Name: (4-methyl-2,3-dihydro-1,4-benzoxazin-7-yl)methanamine SMILES: CN1CCOC2=C1C=CC(=C2)CN
2-Methyl-2-(4-methylphenyl)morpholine, 97%
CAS: 902836-81-1 Molecular Formula: C12H17NO Molecular Weight (g/mol): 191.274 MDL Number: MFCD08060961 InChI Key: NQYMBSUCKZVKFF-UHFFFAOYSA-N Synonym: 2-methyl-2-p-tolyl morpholine,2-methyl-2-4-methylphenyl morpholine,2-methyl-2-p-tolylmorpholine,2-methyl-2-p-tolyl-morpholine,2-4-methylphenyl-2-methylmorpholine,morpholine, 2-methyl-2-4-methylphenyl PubChem CID: 24208807 IUPAC Name: 2-methyl-2-(4-methylphenyl)morpholine SMILES: CC1=CC=C(C=C1)C2(CNCCO2)C