Organoheterocyclic compounds
N,N,N',N'-Tetramethyl-S-(1-oxido-2-pyridyl)thiuronium hexafluorophosphate, 97%, Thermo Scientific™
CAS: 212333-72-7 Molecular Formula: C10H16N3OS·F6P Molecular Weight (g/mol): 371.29 InChI Key: UCOGEMMJHLHOAW-UHFFFAOYSA-N Synonym: hott,n,n,n',n'-tetramethyl-s-1-oxido-2-pyridyl thiuronium hexafluorophosphate,n,n,n',n'-tetramethyl-s-1-oxido-2-pyridyl thiouronium hexafluorophosphate,hott n,n,n',n'-tetramethyl-s-1-oxido-2-pyridyl thiuronium hexafluorophosphate,ambotzrl-1156,acmc-209fij,ksc911c8f,n,n,n',n'-tetramethyl-s-1-oxido-2-pyridyl thiuron,n,n,n',n'-tetramethyl-s-1-oxido-2-pyridyl thiuronhexafluorophosphate,n,n,n,n-tetramethyl-s-1-oxido-2-pyridyl thiouronium hexafluorophosphate PubChem CID: 10571248 IUPAC Name: [dimethylamino-(1-oxidopyridin-1-ium-2-yl)sulfanylmethylidene]-dimethylazanium;hexafluorophosphate SMILES: CN(C)C(=[N+](C)C)SC1=CC=CC=[N+]1[O-].F[P-](F)(F)(F)(F)F
Citrazinic acid, 98%
CAS: 99-11-6 Molecular Formula: C6H5NO4 Molecular Weight (g/mol): 155.11 MDL Number: MFCD00006274 InChI Key: CSGQJHQYWJLPKY-UHFFFAOYSA-N Synonym: citrazinic acid,2,6-dihydroxyisonicotinic acid,2,6-dihydroxypyridine-4-carboxylic acid,2,6-dihydroxy-4-carboxypyridine,2,6-dihydroxy-4-pyridinecarboxylic acid,kyselina citrazinova,2,6-dihydroxyisonicotinate,4-pyridinecarboxylic acid, 2,6-dihydroxy,citrazinicacid,4-pyridinecarboxylic acid, 1,2-dihydro-6-hydroxy-2-oxo PubChem CID: 7425 IUPAC Name: 2-hydroxy-6-oxo-1H-pyridine-4-carboxylic acid SMILES: OC(=O)C1=CC(=O)NC(O)=C1
2-Amino-3-methylpyridine-5-boronic acid pinacol ester, 96%
CAS: 1111637-91-2 Molecular Formula: C12H19BN2O2 Molecular Weight (g/mol): 234.106 MDL Number: MFCD12923388 InChI Key: BWEOUBYDXFBFMA-UHFFFAOYSA-N Synonym: 3-methyl-5-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl pyridin-2-amine,2-amino-3-methylpyridine-5-boronic acid pinacol ester,3-methyl-5-tetramethyl-1,3,2-dioxaborolan-2-yl pyridin-2-amine,6-amino-5-methylpyridin-3-ylboronic acid pinacol ester,6-amino-5-methylpyridine-3-boronic acid pinacol ester,6-amino-5-methylpyridin-3-yl boronic acid pinacol ester,3-methyl-5-4,4,5,5-tetramethyl-1,3,2 dioxaborolan-2-yl pyridin-2-amine,3-methyl-5-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl-2-pyridinamine PubChem CID: 53216772 IUPAC Name: 3-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-amine SMILES: B1(OC(C(O1)(C)C)(C)C)C2=CC(=C(N=C2)N)C
Quinoline N-oxide hydrate, 97% (dry wt.), water ca 20%
CAS: 64201-64-5 Molecular Formula: C9H7NO Molecular Weight (g/mol): 145.16 MDL Number: MFCD00006737 InChI Key: GIIWGCBLYNDKBO-UHFFFAOYSA-N Synonym: quinoline n-oxide hydrate,quinoline, 1-oxide, monohydrate,1-oxidoquinolin-1-ium hydrate,quinoline-n-oxide hydrate,quinoline-1-oxide hydrate,quinolinol, oxamethane,acmc-1be96,quinoline 1-oxide monohydrate,quinoline n-oxide monohydrate PubChem CID: 152363 IUPAC Name: 1-oxidoquinolin-1-ium;hydrate SMILES: [O-][N+]1=CC=CC2=CC=CC=C12
Naltrexone hydrochloride, Thermo Scientific Chemicals
CAS: 16676-29-2 Molecular Formula: C20H24ClNO4 Molecular Weight (g/mol): 377.865 MDL Number: MFCD00069324 InChI Key: RHBRMCOKKKZVRY-ITLPAZOVSA-N Synonym: naltrexone hydrochloride,naltrexone hcl,trexan,depade,antaxone,revia,nalorex,unii-z6375yw9sf,nemexin PubChem CID: 5485201 IUPAC Name: (4R,4aS,7aR,12bS)-3-(cyclopropylmethyl)-4a,9-dihydroxy-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline-7-one;hydrochloride SMILES: C1CC1CN2CCC34C5C(=O)CCC3(C2CC6=C4C(=C(C=C6)O)O5)O.Cl
Thermo Scientific Chemicals Atracurium besylate, 96%
CAS: 64228-81-5 Molecular Formula: C53H72N2O12·2C6H5O3S Molecular Weight (g/mol): 1243.49 InChI Key: XXZSQOVSEBAPGS-UHFFFAOYSA-L Synonym: atracurium besylate,atracurium besilate,tracrium,atracurii besilas,besilate d'atracurium,besilato de atracurio,tracrium preservative free,atracurii besilas inn-latin,bw 33a PubChem CID: 47320 ChEBI: CHEBI:2915 IUPAC Name: benzenesulfonate;5-[3-[1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-2-ium-2-yl]propanoyloxy]pentyl 3-[1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-2-ium-2-yl]propanoate SMILES: C[N+]1(CCC2=CC(=C(C=C2C1CC3=CC(=C(C=C3)OC)OC)OC)OC)CCC(=O)OCCCCCOC(=O)CC[N+]4(CCC5=CC(=C(C=C5C4CC6=CC(=C(C=C6)OC)OC)OC)OC)C.C1=CC=C(C=C1)S(=O)(=O)[O-].C1=CC=C(C=C1)S(=O)(=O)[O-]
1,8-Naphthalimide, 98%
CAS: 81-83-4 Molecular Formula: C12H7NO2 Molecular Weight (g/mol): 197.193 MDL Number: MFCD00006920 InChI Key: XJHABGPPCLHLLV-UHFFFAOYSA-N Synonym: 1,8-naphthalimide,naphthalimide,1h-benz de isoquinoline-1,3 2h-dione,1h-benzo de isoquinoline-1,3 2h-dione,1,8-naphthalenedicarboximide,benzo de isoquinoline-1,3-dione,unii-gi0tv19gbn,naphthalene-1,8-dicarboximide,gi0tv19gbn PubChem CID: 66491 IUPAC Name: benzo[de]isoquinoline-1,3-dione SMILES: C1=CC2=C3C(=C1)C(=O)NC(=O)C3=CC=C2
Naloxone hydrochloride, 98%
CAS: 357-08-4 Molecular Formula: C19H22ClNO4 Molecular Weight (g/mol): 363.838 MDL Number: MFCD00069322 InChI Key: RGPDIGOSVORSAK-STHHAXOLSA-N Synonym: naloxone hydrochloride,naloxone hcl,narcan,evzio,unii-f850569pqr,nalonee,17-allyl-4,5alpha-epoxy-3,14-dihydroxymorphinan-6-one hydrochloride,narcan tn,naloxonehydrochloride PubChem CID: 5464092 IUPAC Name: (4R,4aS,7aR,12bS)-4a,9-dihydroxy-3-prop-2-enyl-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline-7-one;hydrochloride SMILES: C=CCN1CCC23C4C(=O)CCC2(C1CC5=C3C(=C(C=C5)O)O4)O.Cl
Papaverine hydrochloride, 99%
CAS: 61-25-6 Molecular Formula: C20H21NO4·ClH Molecular Weight (g/mol): 375.85 MDL Number: MFCD00012745 InChI Key: UOTMYNBWXDUBNX-UHFFFAOYSA-N Synonym: papaverine hydrochloride,cardiospan,cardoverina,dispamil,drapavel,forpavin,papalease,papaversan,pavatest,paverolan PubChem CID: 6084 IUPAC Name: 1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxyisoquinoline;hydrochloride SMILES: COC1=C(C=C(C=C1)CC2=NC=CC3=CC(=C(C=C32)OC)OC)OC.Cl
4-Amino-1,8-naphthalimide, 95%
CAS: 1742-95-6 Molecular Formula: C12H8N2O2 Molecular Weight (g/mol): 212.21 MDL Number: MFCD00006921 InChI Key: SSMIFVHARFVINF-UHFFFAOYSA-N Synonym: 4-amino-1,8-naphthalimide,4-aminonaphthalimide,6-amino-benzo de isoquinoline-1,3-dione,6-amino-1h-benzo de isoquinoline-1,3 2h-dione,4-aminonaphthalene-1,8-dicarboximide,naphthalimide, 4-amino,dfp 1,1h-benz de isoquinoline-1,3 2h-dione, 6-amino,6-aminobenzo de isoquinoline-1,3-dione,parp inhibitor v, 4-ani PubChem CID: 1720 ChEBI: CHEBI:40071 SMILES: NC1=C2C=CC=C3C(=O)NC(=O)C(C=C1)=C23
3,4-Dihydro-2H-isoquinolin-1-one, 98%
CAS: 1196-38-9 Molecular Formula: C9H9NO Molecular Weight (g/mol): 147.18 InChI Key: YWPMKTWUFVOFPL-UHFFFAOYSA-N Synonym: 3,4-dihydroisoquinolin-1 2h-one,1,2,3,4-tetrahydroisoquinolin-1-one,1 2h-isoquinolinone, 3,4-dihydro,3,4-dihydroisocarbostyril,1-oxo-1,2,3,4-tetrahydroisoquinoline,3,4-dihydro-1 2h-isoquinolinone,3,4-dihydro-1h-isoquinolin-1-one,dihydroisoquinolone,3nuu,1-keto-1,2,3,4-tetrahydroisoquinoline PubChem CID: 150896 IUPAC Name: 3,4-dihydro-2H-isoquinolin-1-one SMILES: C1CNC(=O)C2=CC=CC=C21
3-Pyridin-3-ylaniline, 97%, Thermo Scientific™
CAS: 57976-57-5 Molecular Formula: C11H10N2 Molecular Weight (g/mol): 170.215 InChI Key: YTJQJGKMRLQBJP-UHFFFAOYSA-N Synonym: 3-pyridin-3-yl benzenamine,3-pyridin-3-yl aniline,3-3-aminophenyl pyridine,3-3-pyridyl aniline,benzenamine, 3-3-pyridinyl,3-3-pyridinyl aniline,3-pyridin-3-yl anilin,3-3-pyridyl phenylamine,3-pyridine-3-yl aniline,3-pyridin-3-yl-phenylamine PubChem CID: 459521 IUPAC Name: 3-pyridin-3-ylaniline SMILES: C1=CC(=CC(=C1)N)C2=CN=CC=C2
4-Bromo-2-chloropyridine, 97%
CAS: 73583-37-6 Molecular Formula: C5H3BrClN Molecular Weight (g/mol): 192.44 MDL Number: MFCD03840756 InChI Key: ONHMWUXYIFULDO-UHFFFAOYSA-N Synonym: 2-chloro-4-bromopyridine,pyridine, 4-bromo-2-chloro,4-bromo-2-chloro-pyridine,pubchem1171,acmc-1bjmw,ksc381c4t,tpc-py061,4-bromo-2-chloropyridine,abbypharma ap-18-5387,4-bromo-2-chloropyridine 5g PubChem CID: 3847770 IUPAC Name: 4-bromo-2-chloropyridine SMILES: C1=CN=C(C=C1Br)Cl
5-Phenylnicotinic acid, ≥95%, Thermo Scientific™
CAS: 10177-12-5 Molecular Formula: C12H9NO2 Molecular Weight (g/mol): 199.21 MDL Number: MFCD03086176 InChI Key: VKFXHYRIHRTEIV-UHFFFAOYSA-N Synonym: 5-phenylnicotinic acid,3-pyridinecarboxylic acid, 5-phenyl,5-phenyl-3-pyridinecarboxylic acid,3-phenyl-5-pyridinecarboxylic acid,5-phenylnicotinicacid,akos bar-0484,acmc-1bstf,3-carboxy-5-phenylpyridine,5-phenylnicotinic acid, 95+%,3-pyridinecarboxylicacid,5-phenyl PubChem CID: 346160 IUPAC Name: 5-phenylpyridine-3-carboxylic acid SMILES: OC(=O)C1=CN=CC(=C1)C1=CC=CC=C1